3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4,5-dimethyl-benzoic acid

Systemtic Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4,5-dimethyl-benzoic acid Openeye Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4,5-dimethyl-benzoic acid CAS Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4,5-dimethylbenzoic acid IUPAC Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4,5-dimethylbenzoic acid Traditional Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4,5-dimethyl-benzoic acid Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N2CCCC3=CC=CC=C32)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N2CCCC3=CC=CC=C32)C

InChI

InChI=1S/C18H19NO4S/c1-12-10-15(18(20)21)11-17(13(12)2)24(22,23)19-9-5-7-14-6-3-4-8-16(14)19/h3-4,6,8,10-11H,5,7,9H2,1-2H3,(H,20,21)