ethyl 4-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoate

Systemtic Name: ethyl 4-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoate Openeye Name: ethyl 4-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoate CAS Name: 4-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl-phenethylsulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl-phenethylsulfamoyl]benzoate Traditional Name: 4-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoic acid ethyl ester Formula: C28H28N2O6S MolecularWeight: 520.59672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC3=CC4=C(C=CC(=C4)OC)NC3=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC3=CC4=C(C=CC(=C4)OC)NC3=O

InChI

InChI=1S/C28H28N2O6S/c1-3-36-28(32)21-9-12-25(13-10-21)37(33,34)30(16-15-20-7-5-4-6-8-20)19-23-17-22-18-24(35-2)11-14-26(22)29-27(23)31/h4-14,17-18H,3,15-16,19H2,1-2H3,(H,29,31)