ethyl 5-[3-[(4-chlorophenyl)methoxy]phenyl]-4-(2-methylphenyl)-5-oxidanylidene-pentanoate

Systemtic Name: ethyl 5-[3-[(4-chlorophenyl)methoxy]phenyl]-4-(2-methylphenyl)-5-oxidanylidene-pentanoate Openeye Name: ethyl 5-[3-[(4-chlorophenyl)methoxy]phenyl]-4-(o-tolyl)-5-oxo-pentanoate CAS Name: 5-[3-[(4-chlorophenyl)methoxy]phenyl]-4-(2-methylphenyl)-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl 5-[3-[(4-chlorophenyl)methoxy]phenyl]-4-(2-methylphenyl)-5-oxopentanoate Traditional Name: 5-[3-(4-chlorobenzyl)oxyphenyl]-5-keto-4-(o-tolyl)valeric acid ethyl ester Formula: C27H27ClO4 MolecularWeight: 450.95388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C1=CC=CC=C1C)C(=O)C2=CC(=CC=C2)OCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)CCC(C1=CC=CC=C1C)C(=O)C2=CC(=CC=C2)OCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C27H27ClO4/c1-3-31-26(29)16-15-25(24-10-5-4-7-19(24)2)27(30)21-8-6-9-23(17-21)32-18-20-11-13-22(28)14-12-20/h4-14,17,25H,3,15-16,18H2,1-2H3