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

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[(3-methoxyphenyl)amino]-3,5-dinitro-benzamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-(3-methoxyanilino)-3,5-dinitro-benzamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-(3-methoxyanilino)-3,5-dinitrobenzamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-(3-methoxyanilino)-3,5-dinitrobenzamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-(m-anisidino)-3,5-dinitro-benzamide Formula: C22H19ClN4O8 MolecularWeight: 502.86126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=C(C=C(C=C2C(=O)NC3=CC(=C(C=C3OC)Cl)OC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)NC2=C(C=C(C=C2C(=O)NC3=CC(=C(C=C3OC)Cl)OC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H19ClN4O8/c1-33-14-6-4-5-12(7-14)24-21-15(8-13(26(29)30)9-18(21)27(31)32)22(28)25-17-11-19(34-2)16(23)10-20(17)35-3/h4-11,24H,1-3H3,(H,25,28)