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

Systemtic Name: 2-chloranyl-N-[2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-N-cyclohexyl-benzamide Openeye Name: 2-chloro-N-[2-(4-chloro-3-nitro-anilino)-2-oxo-ethyl]-N-cyclohexyl-benzamide CAS Name: 2-chloro-N-[2-(4-chloro-3-nitroanilino)-2-oxoethyl]-N-cyclohexylbenzamide IUPAC Name: 2-chloro-N-[2-(4-chloro-3-nitroanilino)-2-oxoethyl]-N-cyclohexylbenzamide Traditional Name: 2-chloro-N-[2-(4-chloro-3-nitro-anilino)-2-keto-ethyl]-N-cyclohexyl-benzamide Formula: C21H21Cl2N3O4 MolecularWeight: 450.31514

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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=C3Cl

Isomeric SMILES

C1CCC(CC1)N(CC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H21Cl2N3O4/c22-17-9-5-4-8-16(17)21(28)25(15-6-2-1-3-7-15)13-20(27)24-14-10-11-18(23)19(12-14)26(29)30/h4-5,8-12,15H,1-3,6-7,13H2,(H,24,27)