methyl 4-(2-methylphenyl)-5-(4-methyl-3-phenylmethoxy-phenyl)-5-oxidanylidene-pentanoate

Systemtic Name: methyl 4-(2-methylphenyl)-5-(4-methyl-3-phenylmethoxy-phenyl)-5-oxidanylidene-pentanoate Openeye Name: methyl 5-(3-benzyloxy-4-methyl-phenyl)-4-(o-tolyl)-5-oxo-pentanoate CAS Name: 4-(2-methylphenyl)-5-(4-methyl-3-phenylmethoxyphenyl)-5-oxopentanoic acid methyl ester IUPAC Name: methyl 4-(2-methylphenyl)-5-(4-methyl-3-phenylmethoxyphenyl)-5-oxopentanoate Traditional Name: 5-(3-benzoxy-4-methyl-phenyl)-5-keto-4-(o-tolyl)valeric acid methyl ester Formula: C27H28O4 MolecularWeight: 416.50882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(CCC(=O)OC)C2=CC=CC=C2C)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C(CCC(=O)OC)C2=CC=CC=C2C)OCC3=CC=CC=C3

InChI

InChI=1S/C27H28O4/c1-19-9-7-8-12-23(19)24(15-16-26(28)30-3)27(29)22-14-13-20(2)25(17-22)31-18-21-10-5-4-6-11-21/h4-14,17,24H,15-16,18H2,1-3H3