DIPERODON MONOHYDRATE, (S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H27N3O4.H2O
Molecular Weight	415.4828
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DIPERODON MONOHYDRATE, (S)-

Structure Search

SMILES

O.O=C(NC1=CC=CC=C1)OC[C@H](CN2CCCCC2)OC(=O)NC3=CC=CC=C3

InChI

InChIKey=DUEYECWLQOUBNL-BDQAORGHSA-N

InChI=1S/C22H27N3O4.H2O/c26-21(23-18-10-4-1-5-11-18)28-17-20(16-25-14-8-3-9-15-25)29-22(27)24-19-12-6-2-7-13-19;/h1-2,4-7,10-13,20H,3,8-9,14-17H2,(H,23,26)(H,24,27);1H2/t20-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

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

Molecular Formula	C22H27N3O4
Molecular Weight	397.4675
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:15:12 GMT 2025` Edited by `admin` on `Mon Mar 31 23:15:12 GMT 2025`
Record UNII	4BK2509BPF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DIPERODON MONOHYDRATE, (S)-

Common Name

English

1,2-PROPANEDIOL, 3-(1-PIPERIDINYL)-, BIS(PHENYLCARBAMATE) (ESTER), MONOHYDRATE, (S)-

Preferred Name

English

Code System Code Type Description

FDA UNII

4BK2509BPF

Created by admin on Mon Mar 31 23:15:12 GMT 2025 , Edited by admin on Mon Mar 31 23:15:12 GMT 2025

PRIMARY

PUBCHEM

76969480

Created by admin on Mon Mar 31 23:15:12 GMT 2025 , Edited by admin on Mon Mar 31 23:15:12 GMT 2025

PRIMARY

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