ethyl 4-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: ethyl 4-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(phenylmethyl)sulfamoyl]benzoate Openeye Name: ethyl 4-[benzyl-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate CAS Name: 4-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(phenylmethyl)sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[benzyl-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate Traditional Name: 4-[benzyl-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl]sulfamoyl]benzoic acid ethyl ester Formula: C28H28N2O5S MolecularWeight: 504.59732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC3=CC4=C(C=CC(=C4NC3=O)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC3=CC4=C(C=CC(=C4NC3=O)C)C

InChI

InChI=1S/C28H28N2O5S/c1-4-35-28(32)22-12-14-24(15-13-22)36(33,34)30(17-21-8-6-5-7-9-21)18-23-16-25-19(2)10-11-20(3)26(25)29-27(23)31/h5-16H,4,17-18H2,1-3H3,(H,29,31)