4-(1,3-benzodioxol-5-ylmethyl)-N-[1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]piperazine-1-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethyl)-N-[1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]piperazine-1-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-ylmethyl)-N-[1-(3,4-dimethylphenyl)-5-oxo-pyrrolidin-3-yl]piperazine-1-carboxamide CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-N-[1-(3,4-dimethylphenyl)-5-oxo-3-pyrrolidinyl]-1-piperazinecarboxamide IUPAC Name: 4-(1,3-benzodioxol-5-ylmethyl)-N-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]piperazine-1-carboxamide Traditional Name: N-[1-(3,4-dimethylphenyl)-5-keto-pyrrolidin-3-yl]-4-piperonyl-piperazine-1-carboxamide Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)NC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CC(CC2=O)NC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C25H30N4O4/c1-17-3-5-21(11-18(17)2)29-15-20(13-24(29)30)26-25(31)28-9-7-27(8-10-28)14-19-4-6-22-23(12-19)33-16-32-22/h3-6,11-12,20H,7-10,13-16H2,1-2H3,(H,26,31)