N-(2-methoxyphenyl)-4-[(4-methylphenyl)amino]-3,5-dinitro-benzamide

Systemtic Name: N-(2-methoxyphenyl)-4-[(4-methylphenyl)amino]-3,5-dinitro-benzamide Openeye Name: N-(2-methoxyphenyl)-4-(4-methylanilino)-3,5-dinitro-benzamide CAS Name: N-(2-methoxyphenyl)-4-(4-methylanilino)-3,5-dinitrobenzamide IUPAC Name: N-(2-methoxyphenyl)-4-(4-methylanilino)-3,5-dinitrobenzamide Traditional Name: N-(2-methoxyphenyl)-3,5-dinitro-4-(p-toluidino)benzamide Formula: C21H18N4O6 MolecularWeight: 422.39082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)NC3=CC=CC=C3OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)NC3=CC=CC=C3OC)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O6/c1-13-7-9-15(10-8-13)22-20-17(24(27)28)11-14(12-18(20)25(29)30)21(26)23-16-5-3-4-6-19(16)31-2/h3-12,22H,1-2H3,(H,23,26)