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

Systemtic Name: N-[(2-methoxypyridin-3-yl)methyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[(2-methoxy-3-pyridyl)methyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[(2-methoxy-3-pyridinyl)methyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[(2-methoxypyridin-3-yl)methyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[(2-methoxy-3-pyridyl)methyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C16H14N6O4 MolecularWeight: 354.32016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)CNC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC=N1)CNC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N6O4/c1-26-16-12(3-2-6-18-16)8-19-15(23)11-4-5-13(14(7-11)22(24)25)21-10-17-9-20-21/h2-7,9-10H,8H2,1H3,(H,19,23)