4-[[(3-chlorophenyl)carbonyl-[(3-cyano-4-methoxy-phenyl)methyl]amino]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[(3-chlorophenyl)carbonyl-[(3-cyano-4-methoxy-phenyl)methyl]amino]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[(3-chlorobenzoyl)-[(3-cyano-4-methoxy-phenyl)methyl]amino]carbamoyl]cyclohexanecarboxylic acid CAS Name: 4-[[2-[(3-chlorophenyl)-oxomethyl]-2-[(3-cyano-4-methoxyphenyl)methyl]hydrazinyl]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[(3-chlorobenzoyl)-[(3-cyano-4-methoxyphenyl)methyl]amino]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[(3-chlorobenzoyl)-(3-cyano-4-methoxy-benzyl)amino]carbamoyl]cyclohexanecarboxylic acid Formula: C24H24ClN3O5 MolecularWeight: 469.91746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(C(=O)C2=CC(=CC=C2)Cl)NC(=O)C3CCC(CC3)C(=O)O)C#N

Isomeric SMILES

COC1=C(C=C(C=C1)CN(C(=O)C2=CC(=CC=C2)Cl)NC(=O)C3CCC(CC3)C(=O)O)C#N

InChI

InChI=1S/C24H24ClN3O5/c1-33-21-10-5-15(11-19(21)13-26)14-28(23(30)18-3-2-4-20(25)12-18)27-22(29)16-6-8-17(9-7-16)24(31)32/h2-5,10-12,16-17H,6-9,14H2,1H3,(H,27,29)(H,31,32)