[2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 5-[(5-chloranyl-2-methoxy-phenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: [2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 5-[(5-chloranyl-2-methoxy-phenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: [2-(4-benzyloxyphenyl)-2-oxo-ethyl] 5-(5-chloro-2-methoxy-anilino)-5-oxo-pentanoate CAS Name: 5-(5-chloro-2-methoxyanilino)-5-oxopentanoic acid [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] 5-(5-chloro-2-methoxyanilino)-5-oxopentanoate Traditional Name: 5-(5-chloro-2-methoxy-anilino)-5-keto-valeric acid [2-(4-benzoxyphenyl)-2-keto-ethyl] ester Formula: C27H26ClNO6 MolecularWeight: 495.95144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CCCC(=O)OCC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CCCC(=O)OCC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C27H26ClNO6/c1-33-25-15-12-21(28)16-23(25)29-26(31)8-5-9-27(32)35-18-24(30)20-10-13-22(14-11-20)34-17-19-6-3-2-4-7-19/h2-4,6-7,10-16H,5,8-9,17-18H2,1H3,(H,29,31)