MS-180

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H29N3O5.ClH
Molecular Weight	487.976
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.CCOC(=O)C[C@H]1COC2=CC=C(NC(=O)C3=CC=C(C=C3)C(=N)N4CCOCC4)C=C2C1

InChI

InChIKey=OZOAKFVOTMONAN-LMOVPXPDSA-N

InChI=1S/C25H29N3O5.ClH/c1-2-32-23(29)14-17-13-20-15-21(7-8-22(20)33-16-17)27-25(30)19-5-3-18(4-6-19)24(26)28-9-11-31-12-10-28;/h3-8,15,17,26H,2,9-14,16H2,1H3,(H,27,30);1H/t17-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C25H29N3O5
Molecular Weight	451.5149
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	( - )

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 `Mon Mar 31 22:05:57 GMT 2025` Edited by `admin` on `Mon Mar 31 22:05:57 GMT 2025`
Record UNII	639ZJ7P8SW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MS-180

Code

English

(-)-MS-180

Preferred Name

English

2H-1-BENZOPYRAN-3-ACETIC ACID, 3,4-DIHYDRO-6-((4-(IMINO-4-MORPHOLINYLMETHYL)BENZOYL)AMINO)-, ETHYL ESTER, HYDROCHLORIDE (1:1), (3S)-

Systematic Name

English

(-)-2-(6-(4-(4-MORPHOLINYLCARBONIMIDOYL)BENZAMIDO)-3,4-DIHYDRO-2H-1-BENZOPYRAN-3(S)-YL)ACETIC ACID ETHYL ESTER HYDROCHLORIDE

Systematic Name

English

2H-1-BENZOPYRAN-3-ACETIC ACID, 3,4-DIHYDRO-6-((4-(IMINO-4-MORPHOLINYLMETHYL)BENZOYL)AMINO)-, ETHYL ESTER, MONOHYDROCHLORIDE, (3S)-

Systematic Name

English

MS180

Code

English

Code System Code Type Description

FDA UNII

639ZJ7P8SW

Created by admin on Mon Mar 31 22:05:57 GMT 2025 , Edited by admin on Mon Mar 31 22:05:57 GMT 2025

PRIMARY

CAS

188350-51-8

Created by admin on Mon Mar 31 22:05:57 GMT 2025 , Edited by admin on Mon Mar 31 22:05:57 GMT 2025

PRIMARY

PUBCHEM

10458190

Created by admin on Mon Mar 31 22:05:57 GMT 2025 , Edited by admin on Mon Mar 31 22:05:57 GMT 2025

PRIMARY

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