4-[[4-bromanyl-2-[(3-chloranyl-4-methoxy-phenyl)methylcarbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[4-bromanyl-2-[(3-chloranyl-4-methoxy-phenyl)methylcarbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[4-bromo-2-[(3-chloro-4-methoxy-phenyl)methylcarbamoyl]phenyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: 4-[[4-bromo-2-[[(3-chloro-4-methoxyphenyl)methylamino]-oxomethyl]anilino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[4-bromo-2-[(3-chloro-4-methoxyphenyl)methylcarbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[4-bromo-2-[(3-chloro-4-methoxy-benzyl)carbamoyl]phenyl]carbamoyl]cyclohexanecarboxylic acid Formula: C23H24BrClN2O5 MolecularWeight: 523.80406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)Br)NC(=O)C3CCC(CC3)C(=O)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)Br)NC(=O)C3CCC(CC3)C(=O)O)Cl

InChI

InChI=1S/C23H24BrClN2O5/c1-32-20-9-2-13(10-18(20)25)12-26-22(29)17-11-16(24)7-8-19(17)27-21(28)14-3-5-15(6-4-14)23(30)31/h2,7-11,14-15H,3-6,12H2,1H3,(H,26,29)(H,27,28)(H,30,31)