4-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]benzamide

Systemtic Name: 4-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]benzamide Openeye Name: 4-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide CAS Name: 4-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]benzamide IUPAC Name: 4-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide Traditional Name: N-[3-(2-ketopyrrolidino)propyl]-4-[(3-nitro-1,2,4-triazol-1-yl)methyl]benzamide Formula: C17H20N6O4 MolecularWeight: 372.3785

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCNC(=O)C2=CC=C(C=C2)CN3C=NC(=N3)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)CCCNC(=O)C2=CC=C(C=C2)CN3C=NC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N6O4/c24-15-3-1-9-21(15)10-2-8-18-16(25)14-6-4-13(5-7-14)11-22-12-19-17(20-22)23(26)27/h4-7,12H,1-3,8-11H2,(H,18,25)