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

Systemtic Name: 4-[[(3-chloranyl-4-methoxy-phenyl)methyl-(4-methoxyphenyl)carbonyl-amino]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[(3-chloro-4-methoxy-phenyl)methyl-(4-methoxybenzoyl)amino]carbamoyl]cyclohexanecarboxylic acid CAS Name: 4-[[2-[(3-chloro-4-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)-oxomethyl]hydrazinyl]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[(3-chloro-4-methoxyphenyl)methyl-(4-methoxybenzoyl)amino]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[(3-chloro-4-methoxy-benzyl)-p-anisoyl-amino]carbamoyl]cyclohexanecarboxylic acid Formula: C24H27ClN2O6 MolecularWeight: 474.93398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(CC2=CC(=C(C=C2)OC)Cl)NC(=O)C3CCC(CC3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(CC2=CC(=C(C=C2)OC)Cl)NC(=O)C3CCC(CC3)C(=O)O

InChI

InChI=1S/C24H27ClN2O6/c1-32-19-10-8-17(9-11-19)23(29)27(14-15-3-12-21(33-2)20(25)13-15)26-22(28)16-4-6-18(7-5-16)24(30)31/h3,8-13,16,18H,4-7,14H2,1-2H3,(H,26,28)(H,30,31)