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

Systemtic Name: 3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: 3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]-4-(1,2,4-triazol-1-yl)benzamide CAS Name: 3-nitro-N-[(1-phenyl-4-pyrazolyl)methyl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: 3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: 3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]-4-(1,2,4-triazol-1-yl)benzamide Formula: C19H15N7O3 MolecularWeight: 389.3675

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CNC(=O)C3=CC(=C(C=C3)N4C=NC=N4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CNC(=O)C3=CC(=C(C=C3)N4C=NC=N4)[N+](=O)[O-]

InChI

InChI=1S/C19H15N7O3/c27-19(21-9-14-10-22-24(11-14)16-4-2-1-3-5-16)15-6-7-17(18(8-15)26(28)29)25-13-20-12-23-25/h1-8,10-13H,9H2,(H,21,27)