3-nitro-N-propyl-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: 3-nitro-N-propyl-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: 3-nitro-N-propyl-4-(1,2,4-triazol-1-yl)benzamide CAS Name: 3-nitro-N-propyl-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: 3-nitro-N-propyl-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: 3-nitro-N-propyl-4-(1,2,4-triazol-1-yl)benzamide Formula: C12H13N5O3 MolecularWeight: 275.26332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N5O3/c1-2-5-14-12(18)9-3-4-10(11(6-9)17(19)20)16-8-13-7-15-16/h3-4,6-8H,2,5H2,1H3,(H,14,18)