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

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylcarbonylamino)ethyl]-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxole-5-carbonylamino)ethyl]-1-(3-methoxyphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]ethyl]-1-(3-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxole-5-carbonylamino)ethyl]-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: 5-keto-1-(3-methoxyphenyl)-N-[2-(piperonyloylamino)ethyl]pyrrolidine-3-carboxamide Formula: C22H23N3O6 MolecularWeight: 425.43452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NCCNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NCCNC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H23N3O6/c1-29-17-4-2-3-16(11-17)25-12-15(10-20(25)26)22(28)24-8-7-23-21(27)14-5-6-18-19(9-14)31-13-30-18/h2-6,9,11,15H,7-8,10,12-13H2,1H3,(H,23,27)(H,24,28)