methyl 3-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(4-fluorophenyl)methyl]sulfamoyl]benzoate

Systemtic Name: methyl 3-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(4-fluorophenyl)methyl]sulfamoyl]benzoate Openeye Name: methyl 3-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl-[(4-fluorophenyl)methyl]sulfamoyl]benzoate CAS Name: 3-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl-[(4-fluorophenyl)methyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl-[(4-fluorophenyl)methyl]sulfamoyl]benzoate Traditional Name: 3-[(4-fluorobenzyl)-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]sulfamoyl]benzoic acid methyl ester Formula: C27H25FN2O7S MolecularWeight: 540.560003

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC(=C4)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC(=C4)C(=O)OC)OC

InChI

InChI=1S/C27H25FN2O7S/c1-35-24-13-19-11-20(26(31)29-23(19)14-25(24)36-2)16-30(15-17-7-9-21(28)10-8-17)38(33,34)22-6-4-5-18(12-22)27(32)37-3/h4-14H,15-16H2,1-3H3,(H,29,31)