3-[[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]carbonylamino]benzoic acid

Systemtic Name: 3-[[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]carbonylamino]benzoic acid Openeye Name: 3-[[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoyl]amino]benzoic acid CAS Name: 3-[[[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoyl]amino]benzoic acid Traditional Name: 3-[[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoyl]amino]benzoic acid Formula: C23H20N2O5S MolecularWeight: 436.4803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C23H20N2O5S/c26-22(24-19-10-3-8-18(14-19)23(27)28)17-7-4-11-20(15-17)31(29,30)25-13-5-9-16-6-1-2-12-21(16)25/h1-4,6-8,10-12,14-15H,5,9,13H2,(H,24,26)(H,27,28)