1-(1,3-benzodioxol-5-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-yl)-N-[3-(1-imidazolylmethyl)phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(1,3-benzodioxol-5-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]-5-keto-pyrrolidine-3-carboxamide Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC3=C(C=C2)OCO3)C(=O)NC4=CC=CC(=C4)CN5C=CN=C5

Isomeric SMILES

C1C(CN(C1=O)C2=CC3=C(C=C2)OCO3)C(=O)NC4=CC=CC(=C4)CN5C=CN=C5

InChI

InChI=1S/C22H20N4O4/c27-21-9-16(12-26(21)18-4-5-19-20(10-18)30-14-29-19)22(28)24-17-3-1-2-15(8-17)11-25-7-6-23-13-25/h1-8,10,13,16H,9,11-12,14H2,(H,24,28)