N-[3-methyl-4-[(2-methylphenyl)diazenyl]phenyl]-3,5-dinitro-benzamide

Systemtic Name: N-[3-methyl-4-[(2-methylphenyl)diazenyl]phenyl]-3,5-dinitro-benzamide Openeye Name: N-[3-methyl-4-(o-tolylazo)phenyl]-3,5-dinitro-benzamide CAS Name: N-[3-methyl-4-(2-methylphenyl)azophenyl]-3,5-dinitrobenzamide IUPAC Name: N-[3-methyl-4-[(2-methylphenyl)diazenyl]phenyl]-3,5-dinitrobenzamide Traditional Name: N-[3-methyl-4-(o-tolylazo)phenyl]-3,5-dinitro-benzamide Formula: C21H17N5O5 MolecularWeight: 419.39018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N=NC2=C(C=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=CC=C1N=NC2=C(C=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C21H17N5O5/c1-13-5-3-4-6-19(13)23-24-20-8-7-16(9-14(20)2)22-21(27)15-10-17(25(28)29)12-18(11-15)26(30)31/h3-12H,1-2H3,(H,22,27)