N-(2-chloranyl-4-nitro-phenyl)-2-[(4-methylphenyl)amino]-3,5-dinitro-benzamide

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-2-[(4-methylphenyl)amino]-3,5-dinitro-benzamide Openeye Name: N-(2-chloro-4-nitro-phenyl)-2-(4-methylanilino)-3,5-dinitro-benzamide CAS Name: N-(2-chloro-4-nitrophenyl)-2-(4-methylanilino)-3,5-dinitrobenzamide IUPAC Name: N-(2-chloro-4-nitrophenyl)-2-(4-methylanilino)-3,5-dinitrobenzamide Traditional Name: N-(2-chloro-4-nitro-phenyl)-3,5-dinitro-2-(p-toluidino)benzamide Formula: C20H14ClN5O7 MolecularWeight: 471.80746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C=C(C=C2C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C=C(C=C2C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H14ClN5O7/c1-11-2-4-12(5-3-11)22-19-15(8-14(25(30)31)10-18(19)26(32)33)20(27)23-17-7-6-13(24(28)29)9-16(17)21/h2-10,22H,1H3,(H,23,27)