ethyl 5-[7-[(3-chlorophenyl)sulfamoyl]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate

Systemtic Name: ethyl 5-[7-[(3-chlorophenyl)sulfamoyl]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate Openeye Name: ethyl 5-[7-[(3-chlorophenyl)sulfamoyl]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate CAS Name: 5-[7-[(3-chlorophenyl)sulfamoyl]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[7-[(3-chlorophenyl)sulfamoyl]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate Traditional Name: 5-[7-[(3-chlorophenyl)sulfamoyl]-3,4-dihydro-1H-isoquinolin-2-yl]valeric acid ethyl ester Formula: C22H27ClN2O4S MolecularWeight: 450.97878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCN1CCC2=C(C1)C=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)CCCCN1CCC2=C(C1)C=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H27ClN2O4S/c1-2-29-22(26)8-3-4-12-25-13-11-17-9-10-21(14-18(17)16-25)30(27,28)24-20-7-5-6-19(23)15-20/h5-7,9-10,14-15,24H,2-4,8,11-13,16H2,1H3