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

Systemtic Name: N-[1-(4-methylphenyl)ethyl]-3,5-dinitro-benzamide Openeye Name: 3,5-dinitro-N-[1-(p-tolyl)ethyl]benzamide CAS Name: N-[1-(4-methylphenyl)ethyl]-3,5-dinitrobenzamide IUPAC Name: N-[1-(4-methylphenyl)ethyl]-3,5-dinitrobenzamide Traditional Name: 3,5-dinitro-N-[1-(p-tolyl)ethyl]benzamide Formula: C16H15N3O5 MolecularWeight: 329.3074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O5/c1-10-3-5-12(6-4-10)11(2)17-16(20)13-7-14(18(21)22)9-15(8-13)19(23)24/h3-9,11H,1-2H3,(H,17,20)