N-[2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-N-cyclohexyl-3-nitro-benzamide

Systemtic Name: N-[2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-N-cyclohexyl-3-nitro-benzamide Openeye Name: N-[2-(4-chloro-3-nitro-anilino)-2-oxo-ethyl]-N-cyclohexyl-3-nitro-benzamide CAS Name: N-[2-(4-chloro-3-nitroanilino)-2-oxoethyl]-N-cyclohexyl-3-nitrobenzamide IUPAC Name: N-[2-(4-chloro-3-nitroanilino)-2-oxoethyl]-N-cyclohexyl-3-nitrobenzamide Traditional Name: N-[2-(4-chloro-3-nitro-anilino)-2-keto-ethyl]-N-cyclohexyl-3-nitro-benzamide Formula: C21H21ClN4O6 MolecularWeight: 460.86764

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N(CC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21ClN4O6/c22-18-10-9-15(12-19(18)26(31)32)23-20(27)13-24(16-6-2-1-3-7-16)21(28)14-5-4-8-17(11-14)25(29)30/h4-5,8-12,16H,1-3,6-7,13H2,(H,23,27)