1-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-oxomethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C26H24N2O5S MolecularWeight: 476.54416

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC=C2N(C1)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4)C(=O)O

Isomeric SMILES

C1CC2=C(C=CC=C2N(C1)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4)C(=O)O

InChI

InChI=1S/C26H24N2O5S/c29-25(28-14-5-11-22-23(26(30)31)10-4-12-24(22)28)19-8-3-9-21(16-19)34(32,33)27-15-13-18-6-1-2-7-20(18)17-27/h1-4,6-10,12,16H,5,11,13-15,17H2,(H,30,31)