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

Systemtic Name: 3-nitro-N-(1-phenylethyl)-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: 3-nitro-N-(1-phenylethyl)-4-(1,2,4-triazol-1-yl)benzamide CAS Name: 3-nitro-N-(1-phenylethyl)-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: 3-nitro-N-(1-phenylethyl)-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: 3-nitro-N-(1-phenylethyl)-4-(1,2,4-triazol-1-yl)benzamide Formula: C17H15N5O3 MolecularWeight: 337.3327

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O3/c1-12(13-5-3-2-4-6-13)20-17(23)14-7-8-15(16(9-14)22(24)25)21-11-18-10-19-21/h2-12H,1H3,(H,20,23)