N-[2-(1,3-benzodioxol-5-ylcarbonylamino)ethyl]-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylcarbonylamino)ethyl]-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxole-5-carbonylamino)ethyl]-5-oxo-1-phenyl-pyrrolidine-3-carboxamide CAS Name: N-[2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]ethyl]-5-oxo-1-phenyl-3-pyrrolidinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxole-5-carbonylamino)ethyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide Traditional Name: 5-keto-1-phenyl-N-[2-(piperonyloylamino)ethyl]pyrrolidine-3-carboxamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=CC=C2)C(=O)NCCNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C(CN(C1=O)C2=CC=CC=C2)C(=O)NCCNC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21N3O5/c25-19-11-15(12-24(19)16-4-2-1-3-5-16)21(27)23-9-8-22-20(26)14-6-7-17-18(10-14)29-13-28-17/h1-7,10,15H,8-9,11-13H2,(H,22,26)(H,23,27)