methyl 3-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoate

Systemtic Name: methyl 3-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoate Openeye Name: methyl 3-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoate CAS Name: 3-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl-phenethylsulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl-phenethylsulfamoyl]benzoate Traditional Name: 3-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoic acid methyl ester Formula: C27H26N2O6S MolecularWeight: 506.57014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC(=C4)C(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC(=C4)C(=O)OC

InChI

InChI=1S/C27H26N2O6S/c1-34-23-12-11-20-15-22(26(30)28-25(20)17-23)18-29(14-13-19-7-4-3-5-8-19)36(32,33)24-10-6-9-21(16-24)27(31)35-2/h3-12,15-17H,13-14,18H2,1-2H3,(H,28,30)