3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzoic acid

Systemtic Name: 3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzoic acid Openeye Name: 3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzoic acid CAS Name: 3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzoic acid IUPAC Name: 3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzoic acid Traditional Name: 3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzoic acid Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CCC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(CCC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C17H17NO4S/c1-12-7-8-16-13(10-12)5-3-9-18(16)23(21,22)15-6-2-4-14(11-15)17(19)20/h2,4,6-8,10-11H,3,5,9H2,1H3,(H,19,20)