(S)-7-[(5,7-Difluoro-3,4-dihydro-2H-1-benzopyran-4-yl)oxy]-2-methyl-1H-benzimidazole-5-carboxylic acid

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H14F2N2O4
Molecular Weight	360.3116
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (S)-7-[(5,7-Difluoro-3,4-dihydro-2H-1-benzopyran-4-yl)oxy]-2-methyl-1H-benzimidazole-5-carboxylic acid

Structure Search

SMILES

CC1=NC2=CC(=CC(O[C@H]3CCOC4=CC(F)=CC(F)=C34)=C2N1)C(O)=O

InChI

InChIKey=ISYSUUMRBSNENL-ZDUSSCGKSA-N

InChI=1S/C18H14F2N2O4/c1-8-21-12-4-9(18(23)24)5-15(17(12)22-8)26-13-2-3-25-14-7-10(19)6-11(20)16(13)14/h4-7,13H,2-3H2,1H3,(H,21,22)(H,23,24)/t13-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C18H14F2N2O4
Molecular Weight	360.3116
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 `Wed Apr 02 19:33:55 GMT 2025` Edited by `admin` on `Wed Apr 02 19:33:55 GMT 2025`
Record UNII	T2Z2BT2WCA
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(S)-7-[(5,7-Difluoro-3,4-dihydro-2H-1-benzopyran-4-yl)oxy]-2-methyl-1H-benzimidazole-5-carboxylic acid

Systematic Name

English

(-)-7-[(5,7-Difluoro-3,4-dihydro-2H-1-benzopyran-4-yl)oxy]-2-methyl-1H-benzimidazole-5-carboxylic acid

Preferred Name

English

Code System Code Type Description

CAS

942195-95-1

Created by admin on Wed Apr 02 19:33:55 GMT 2025 , Edited by admin on Wed Apr 02 19:33:55 GMT 2025

NON-SPECIFIC STEREOCHEMISTRY

FDA UNII

T2Z2BT2WCA

Created by admin on Wed Apr 02 19:33:55 GMT 2025 , Edited by admin on Wed Apr 02 19:33:55 GMT 2025

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CAS

942196-03-4

Created by admin on Wed Apr 02 19:33:55 GMT 2025 , Edited by admin on Wed Apr 02 19:33:55 GMT 2025

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PUBCHEM

169438006

Created by admin on Wed Apr 02 19:33:55 GMT 2025 , Edited by admin on Wed Apr 02 19:33:55 GMT 2025

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