ethyl 4-[1,3-benzodioxol-5-ylmethyl-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate

Systemtic Name: ethyl 4-[1,3-benzodioxol-5-ylmethyl-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate Openeye Name: ethyl 4-[1,3-benzodioxol-5-ylmethyl-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate CAS Name: 4-[1,3-benzodioxol-5-ylmethyl-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[1,3-benzodioxol-5-ylmethyl-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate Traditional Name: 4-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl-piperonyl-sulfamoyl]benzoic acid ethyl ester Formula: C28H26N2O7S MolecularWeight: 534.58024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C(=CC=C5)C)NC4=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C(=CC=C5)C)NC4=O

InChI

InChI=1S/C28H26N2O7S/c1-3-35-28(32)20-8-10-23(11-9-20)38(33,34)30(15-19-7-12-24-25(13-19)37-17-36-24)16-22-14-21-6-4-5-18(2)26(21)29-27(22)31/h4-14H,3,15-17H2,1-2H3,(H,29,31)