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N-(4-methylphenyl)-3,5-dinitro-2-(phenethylamino)benzamide

N-(4-methylphenyl)-3,5-dinitro-2-(phenethylamino)benzamide

Systemtic Name:N-(4-methylphenyl)-3,5-dinitro-2-(phenethylamino)benzamide
Openeye Name:3,5-dinitro-2-(phenethylamino)-N-(p-tolyl)benzamide
CAS Name:N-(4-methylphenyl)-3,5-dinitro-2-(phenethylamino)benzamide
IUPAC Name:N-(4-methylphenyl)-3,5-dinitro-2-(phenethylamino)benzamide
Traditional Name:3,5-dinitro-2-(phenethylamino)-N-(p-tolyl)benzamide
Formula: C22H20N4O5
MolecularWeight: 420.418
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2NCCC3=CC=CC=C3)[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2NCCC3=CC=CC=C3)[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C22H20N4O5/c1-15-7-9-17(10-8-15)24-22(27)19-13-18(25(28)29)14-20(26(30)31)21(19)23-12-11-16-5-3-2-4-6-16/h2-10,13-14,23H,11-12H2,1H3,(H,24,27)


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