N-[5-chloranyl-4-[(4-chlorophenyl)-cyano-methyl]-2-propan-2-yl-phenyl]-5-ethyl-2-methyl-3-nitro-6-oxidanyl-benzamide

Systemtic Name: N-[5-chloranyl-4-[(4-chlorophenyl)-cyano-methyl]-2-propan-2-yl-phenyl]-5-ethyl-2-methyl-3-nitro-6-oxidanyl-benzamide Openeye Name: N-[5-chloro-4-[(4-chlorophenyl)-cyano-methyl]-2-isopropyl-phenyl]-3-ethyl-2-hydroxy-6-methyl-5-nitro-benzamide CAS Name: N-[5-chloro-4-[(4-chlorophenyl)-cyanomethyl]-2-propan-2-ylphenyl]-3-ethyl-2-hydroxy-6-methyl-5-nitrobenzamide IUPAC Name: N-[5-chloro-4-[(4-chlorophenyl)-cyanomethyl]-2-propan-2-ylphenyl]-3-ethyl-2-hydroxy-6-methyl-5-nitrobenzamide Traditional Name: N-[5-chloro-4-[(4-chlorophenyl)-cyano-methyl]-2-isopropyl-phenyl]-3-ethyl-2-hydroxy-6-methyl-5-nitro-benzamide Formula: C27H25Cl2N3O4 MolecularWeight: 526.4111

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1O)C(=O)NC2=CC(=C(C=C2C(C)C)C(C#N)C3=CC=C(C=C3)Cl)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC(=C(C(=C1O)C(=O)NC2=CC(=C(C=C2C(C)C)C(C#N)C3=CC=C(C=C3)Cl)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C27H25Cl2N3O4/c1-5-16-10-24(32(35)36)15(4)25(26(16)33)27(34)31-23-12-22(29)20(11-19(23)14(2)3)21(13-30)17-6-8-18(28)9-7-17/h6-12,14,21,33H,5H2,1-4H3,(H,31,34)