[4-(1H-indol-3-yl)-2-oxidanylidene-butyl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [4-(1H-indol-3-yl)-2-oxidanylidene-butyl] 1,3-benzodioxole-5-carboxylate Openeye Name: [4-(1H-indol-3-yl)-2-oxo-butyl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [4-(1H-indol-3-yl)-2-oxobutyl] ester IUPAC Name: [4-(1H-indol-3-yl)-2-oxobutyl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [4-(1H-indol-3-yl)-2-keto-butyl] ester Formula: C20H17NO5 MolecularWeight: 351.35268

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)OCC(=O)CCC3=CNC4=CC=CC=C43

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)OCC(=O)CCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C20H17NO5/c22-15(7-5-14-10-21-17-4-2-1-3-16(14)17)11-24-20(23)13-6-8-18-19(9-13)26-12-25-18/h1-4,6,8-10,21H,5,7,11-12H2