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

Systemtic Name: 3-nitro-N-phenethyl-N-(phenylmethyl)-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-benzyl-3-nitro-N-phenethyl-4-(1,2,4-triazol-1-yl)benzamide CAS Name: 3-nitro-N-phenethyl-N-(phenylmethyl)-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-benzyl-3-nitro-N-phenethyl-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-benzyl-3-nitro-N-phenethyl-4-(1,2,4-triazol-1-yl)benzamide Formula: C24H21N5O3 MolecularWeight: 427.45524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)N4C=NC=N4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)N4C=NC=N4)[N+](=O)[O-]

InChI

InChI=1S/C24H21N5O3/c30-24(21-11-12-22(23(15-21)29(31)32)28-18-25-17-26-28)27(16-20-9-5-2-6-10-20)14-13-19-7-3-1-4-8-19/h1-12,15,17-18H,13-14,16H2