ETHYL (2R,4R)-1-((2S)-2-AMINO-5-(N'-NITROCARBAMIMIDAMIDO)PENTANOYL)-4-METHYLPIPERIDINE-2-CARBOXYLATE HYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H28N6O5.ClH
Molecular Weight	408.881
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of ETHYL (2R,4R)-1-((2S)-2-AMINO-5-(N'-NITROCARBAMIMIDAMIDO)PENTANOYL)-4-METHYLPIPERIDINE-2-CARBOXYLATE HYDROCHLORIDE

Structure Search

SMILES

Cl.CCOC(=O)[C@H]1C[C@H](C)CCN1C(=O)[C@@H](N)CCCN\C(N)=N/[N+]([O-])=O

InChI

InChIKey=KYMBEZAOVMYAGM-QMCLHUHBSA-N

InChI=1S/C15H28N6O5.ClH/c1-3-26-14(23)12-9-10(2)6-8-20(12)13(22)11(16)5-4-7-18-15(17)19-21(24)25;/h10-12H,3-9,16H2,1-2H3,(H3,17,18,19);1H/t10-,11+,12-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C15H28N6O5
Molecular Weight	372.42
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	1
Optical Activity	UNSPECIFIED

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:18:54 GMT 2023` Edited by `admin` on `Sat Dec 16 18:18:54 GMT 2023`
Record UNII	3ZW9ZW5XJN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETHYL (2R,4R)-1-((2S)-2-AMINO-5-(N'-NITROCARBAMIMIDAMIDO)PENTANOYL)-4-METHYLPIPERIDINE-2-CARBOXYLATE HYDROCHLORIDE

Systematic Name

English

(2R,4R)-ETHYL 1-(2-AMINO-5-(3-NITROGUANIDINO)PENTANOYL)-4-METHYLPIPERIDINE-2-CARBOXYLATE HYDROCHLORIDE

Common Name

English

2-PIPERIDINECARBOXYLIC ACID, 1-((2S)-2-AMINO-5-((IMINO(NITROAMINO)METHYL)AMINO)-1-OXOPENTYL)-4-METHYL-, ETHYL ESTER, HYDROCHLORIDE (1:1), (2R,4R)-

Systematic Name

English

2-PIPERIDINECARBOXYLIC ACID, 1-(2-AMINO-5-((IMINO(NITROAMINO)METHYL)AMINO)-1-OXOPENTYL)-4-METHYL-, ETHYL ESTER, MONOHYDROCHLORIDE, (2R-(1(S*),2.ALPHA.,4.BETA.))-

Common Name

English

Code System Code Type Description

CAS

74874-08-1

Created by admin on Sat Dec 16 18:18:54 GMT 2023 , Edited by admin on Sat Dec 16 18:18:54 GMT 2023

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PUBCHEM

46780287

Created by admin on Sat Dec 16 18:18:54 GMT 2023 , Edited by admin on Sat Dec 16 18:18:54 GMT 2023

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FDA UNII

3ZW9ZW5XJN

Created by admin on Sat Dec 16 18:18:54 GMT 2023 , Edited by admin on Sat Dec 16 18:18:54 GMT 2023

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