methyl 3-[[5-chloranyl-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[5-chloranyl-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[5-chloro-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[5-chloro-4-[(4-chlorophenyl)-cyanomethyl]-2-methylanilino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[5-chloro-4-[(4-chlorophenyl)-cyanomethyl]-2-methylphenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[5-chloro-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-phenyl]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C24H17Cl2N3O5 MolecularWeight: 498.31488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC)Cl)C(C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC)Cl)C(C#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H17Cl2N3O5/c1-13-7-19(20(12-27)14-3-5-17(25)6-4-14)21(26)11-22(13)28-23(30)15-8-16(24(31)34-2)10-18(9-15)29(32)33/h3-11,20H,1-2H3,(H,28,30)