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

Systemtic Name: methyl 2-[1,3-benzodioxol-5-ylmethyl-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate Openeye Name: methyl 2-[1,3-benzodioxol-5-ylmethyl-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate CAS Name: 2-[1,3-benzodioxol-5-ylmethyl-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[1,3-benzodioxol-5-ylmethyl-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate Traditional Name: 2-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl-piperonyl-sulfamoyl]benzoic acid methyl ester Formula: C28H26N2O8S MolecularWeight: 550.57964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=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

CCOC1=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/C28H26N2O8S/c1-3-36-21-9-10-23-19(14-21)13-20(27(31)29-23)16-30(15-18-8-11-24-25(12-18)38-17-37-24)39(33,34)26-7-5-4-6-22(26)28(32)35-2/h4-14H,3,15-17H2,1-2H3,(H,29,31)