N-(4-methylphenyl)-3,5-dinitro-2-piperidin-1-yl-benzamide

Systemtic Name: N-(4-methylphenyl)-3,5-dinitro-2-piperidin-1-yl-benzamide Openeye Name: 3,5-dinitro-2-(1-piperidyl)-N-(p-tolyl)benzamide CAS Name: N-(4-methylphenyl)-3,5-dinitro-2-(1-piperidinyl)benzamide IUPAC Name: N-(4-methylphenyl)-3,5-dinitro-2-piperidin-1-ylbenzamide Traditional Name: 3,5-dinitro-2-piperidino-N-(p-tolyl)benzamide Formula: C19H20N4O5 MolecularWeight: 384.3859

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2N3CCCCC3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2N3CCCCC3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O5/c1-13-5-7-14(8-6-13)20-19(24)16-11-15(22(25)26)12-17(23(27)28)18(16)21-9-3-2-4-10-21/h5-8,11-12H,2-4,9-10H2,1H3,(H,20,24)