4-[2-[(1-ethanoyl-3,4-dihydro-2H-quinolin-6-yl)sulfonylamino]ethyl]benzoic acid

Systemtic Name: 4-[2-[(1-ethanoyl-3,4-dihydro-2H-quinolin-6-yl)sulfonylamino]ethyl]benzoic acid Openeye Name: 4-[2-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)sulfonylamino]ethyl]benzoic acid CAS Name: 4-[2-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)sulfonylamino]ethyl]benzoic acid IUPAC Name: 4-[2-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)sulfonylamino]ethyl]benzoic acid Traditional Name: 4-[2-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)sulfonylamino]ethyl]benzoic acid Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)NCCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)NCCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H22N2O5S/c1-14(23)22-12-2-3-17-13-18(8-9-19(17)22)28(26,27)21-11-10-15-4-6-16(7-5-15)20(24)25/h4-9,13,21H,2-3,10-12H2,1H3,(H,24,25)