methyl 2-[1,3-benzodioxol-5-ylmethyl-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate

Systemtic Name: methyl 2-[1,3-benzodioxol-5-ylmethyl-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate Openeye Name: methyl 2-[1,3-benzodioxol-5-ylmethyl-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate CAS Name: 2-[1,3-benzodioxol-5-ylmethyl-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[1,3-benzodioxol-5-ylmethyl-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate Traditional Name: 2-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl-piperonyl-sulfamoyl]benzoic acid methyl ester Formula: C27H24N2O7S MolecularWeight: 520.55366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC=C5C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC=C5C(=O)OC

InChI

InChI=1S/C27H24N2O7S/c1-17-7-9-22-19(11-17)13-20(26(30)28-22)15-29(14-18-8-10-23-24(12-18)36-16-35-23)37(32,33)25-6-4-3-5-21(25)27(31)34-2/h3-13H,14-16H2,1-2H3,(H,28,30)