2-[7-[(3-chlorophenyl)sulfamoyl]-3,4-dihydro-1H-isoquinolin-2-yl]butanoic acid

Systemtic Name: 2-[7-[(3-chlorophenyl)sulfamoyl]-3,4-dihydro-1H-isoquinolin-2-yl]butanoic acid Openeye Name: 2-[7-[(3-chlorophenyl)sulfamoyl]-3,4-dihydro-1H-isoquinolin-2-yl]butanoic acid CAS Name: 2-[7-[(3-chlorophenyl)sulfamoyl]-3,4-dihydro-1H-isoquinolin-2-yl]butanoic acid IUPAC Name: 2-[7-[(3-chlorophenyl)sulfamoyl]-3,4-dihydro-1H-isoquinolin-2-yl]butanoic acid Traditional Name: 2-[7-[(3-chlorophenyl)sulfamoyl]-3,4-dihydro-1H-isoquinolin-2-yl]butyric acid Formula: C19H21ClN2O4S MolecularWeight: 408.89904

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N1CCC2=C(C1)C=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CCC(C(=O)O)N1CCC2=C(C1)C=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H21ClN2O4S/c1-2-18(19(23)24)22-9-8-13-6-7-17(10-14(13)12-22)27(25,26)21-16-5-3-4-15(20)11-16/h3-7,10-11,18,21H,2,8-9,12H2,1H3,(H,23,24)