butyl 4-[[1-(4-methylphenyl)carbonyl-3,4-dihydro-2H-quinolin-6-yl]sulfonylamino]benzoate

Systemtic Name: butyl 4-[[1-(4-methylphenyl)carbonyl-3,4-dihydro-2H-quinolin-6-yl]sulfonylamino]benzoate Openeye Name: butyl 4-[[1-(4-methylbenzoyl)-3,4-dihydro-2H-quinolin-6-yl]sulfonylamino]benzoate CAS Name: 4-[[1-[(4-methylphenyl)-oxomethyl]-3,4-dihydro-2H-quinolin-6-yl]sulfonylamino]benzoic acid butyl ester IUPAC Name: butyl 4-[[1-(4-methylbenzoyl)-3,4-dihydro-2H-quinolin-6-yl]sulfonylamino]benzoate Traditional Name: 4-[(1-p-toluoyl-3,4-dihydro-2H-quinolin-6-yl)sulfonylamino]benzoic acid butyl ester Formula: C28H30N2O5S MolecularWeight: 506.6132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(CCC3)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(CCC3)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C28H30N2O5S/c1-3-4-18-35-28(32)22-11-13-24(14-12-22)29-36(33,34)25-15-16-26-23(19-25)6-5-17-30(26)27(31)21-9-7-20(2)8-10-21/h7-16,19,29H,3-6,17-18H2,1-2H3