N-[(3S)-1-(3,4-dimethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(3S)-1-(3,4-dimethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(3S)-1-(3,4-dimethoxyphenyl)-5-oxo-pyrrolidin-3-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(3S)-1-(3,4-dimethoxyphenyl)-5-oxo-3-pyrrolidinyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(3S)-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidin-3-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(3S)-1-(3,4-dimethoxyphenyl)-5-keto-pyrrolidin-3-yl]-piperonylamide Formula: C20H20N2O6 MolecularWeight: 384.3826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2CC(CC2=O)NC(=O)C3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C[C@H](CC2=O)NC(=O)C3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C20H20N2O6/c1-25-15-6-4-14(9-17(15)26-2)22-10-13(8-19(22)23)21-20(24)12-3-5-16-18(7-12)28-11-27-16/h3-7,9,13H,8,10-11H2,1-2H3,(H,21,24)/t13-/m0/s1