[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)pyrrolidin-1-yl]-(3,4-dimethoxyphenyl)methanone

Systemtic Name: [(2E)-2-(1,3-benzodioxol-5-ylmethylidene)pyrrolidin-1-yl]-(3,4-dimethoxyphenyl)methanone Openeye Name: [(2E)-2-(1,3-benzodioxol-5-ylmethylene)pyrrolidin-1-yl]-(3,4-dimethoxyphenyl)methanone CAS Name: [(2E)-2-(1,3-benzodioxol-5-ylmethylidene)-1-pyrrolidinyl]-(3,4-dimethoxyphenyl)methanone IUPAC Name: [(2E)-2-(1,3-benzodioxol-5-ylmethylidene)pyrrolidin-1-yl]-(3,4-dimethoxyphenyl)methanone Traditional Name: (3,4-dimethoxyphenyl)-[(2E)-2-piperonylidenepyrrolidino]methanone Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCCC2=CC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N\2CCC/C2=C\C3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C21H21NO5/c1-24-17-8-6-15(12-19(17)25-2)21(23)22-9-3-4-16(22)10-14-5-7-18-20(11-14)27-13-26-18/h5-8,10-12H,3-4,9,13H2,1-2H3/b16-10+