N-[2-(4-methylphenyl)-1-phenyl-ethyl]-3,5-dinitro-benzamide

Systemtic Name: N-[2-(4-methylphenyl)-1-phenyl-ethyl]-3,5-dinitro-benzamide Openeye Name: 3,5-dinitro-N-[1-phenyl-2-(p-tolyl)ethyl]benzamide CAS Name: N-[2-(4-methylphenyl)-1-phenylethyl]-3,5-dinitrobenzamide IUPAC Name: N-[2-(4-methylphenyl)-1-phenylethyl]-3,5-dinitrobenzamide Traditional Name: 3,5-dinitro-N-[1-phenyl-2-(p-tolyl)ethyl]benzamide Formula: C22H19N3O5 MolecularWeight: 405.40336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C2=CC=CC=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CC(C2=CC=CC=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O5/c1-15-7-9-16(10-8-15)11-21(17-5-3-2-4-6-17)23-22(26)18-12-19(24(27)28)14-20(13-18)25(29)30/h2-10,12-14,21H,11H2,1H3,(H,23,26)