3-nitro-N-[2-oxidanylidene-2-(propylamino)ethyl]-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: 3-nitro-N-[2-oxidanylidene-2-(propylamino)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: 3-nitro-N-[2-oxo-2-(propylamino)ethyl]-4-(1,2,4-triazol-1-yl)benzamide CAS Name: 3-nitro-N-[2-oxo-2-(propylamino)ethyl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: 3-nitro-N-[2-oxo-2-(propylamino)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[2-keto-2-(propylamino)ethyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C14H16N6O4 MolecularWeight: 332.31464

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNC(=O)C1=CC(=C(C=C1)N2C=NC=N2)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)CNC(=O)C1=CC(=C(C=C1)N2C=NC=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N6O4/c1-2-5-16-13(21)7-17-14(22)10-3-4-11(12(6-10)20(23)24)19-9-15-8-18-19/h3-4,6,8-9H,2,5,7H2,1H3,(H,16,21)(H,17,22)