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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=C(C=C2C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=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/c21-16-9-13(24(28)29)6-7-17(16)23-20(27)15-8-14(25(30)31)10-18(26(32)33)19(15)22-11-12-4-2-1-3-5-12/h1-10,22H,11H2,(H,23,27)