1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-N-[2-(4-pyrazol-1-ylphenyl)ethyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-N-[2-(4-pyrazol-1-ylphenyl)ethyl]pyrrolidine-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-yl)-5-oxo-N-[2-(4-pyrazol-1-ylphenyl)ethyl]pyrrolidine-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-yl)-5-oxo-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-yl)-5-oxo-N-[2-(4-pyrazol-1-ylphenyl)ethyl]pyrrolidine-3-carboxamide Traditional Name: 1-(1,3-benzodioxol-5-yl)-5-keto-N-[2-(4-pyrazol-1-ylphenyl)ethyl]pyrrolidine-3-carboxamide Formula: C23H22N4O4 MolecularWeight: 418.44518

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC3=C(C=C2)OCO3)C(=O)NCCC4=CC=C(C=C4)N5C=CC=N5

Isomeric SMILES

C1C(CN(C1=O)C2=CC3=C(C=C2)OCO3)C(=O)NCCC4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C23H22N4O4/c28-22-12-17(14-26(22)19-6-7-20-21(13-19)31-15-30-20)23(29)24-10-8-16-2-4-18(5-3-16)27-11-1-9-25-27/h1-7,9,11,13,17H,8,10,12,14-15H2,(H,24,29)