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

Systemtic Name: methyl 2-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoate Openeye Name: methyl 2-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoate CAS Name: 2-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl-phenethylsulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl-phenethylsulfamoyl]benzoate Traditional Name: 2-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoic acid methyl ester Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C27H26N2O5S/c1-19-12-13-21-17-22(26(30)28-24(21)16-19)18-29(15-14-20-8-4-3-5-9-20)35(32,33)25-11-7-6-10-23(25)27(31)34-2/h3-13,16-17H,14-15,18H2,1-2H3,(H,28,30)