methyl 7-oxidanylidene-6-phenyl-7-(3-phenylmethoxyphenyl)heptanoate

Systemtic Name: methyl 7-oxidanylidene-6-phenyl-7-(3-phenylmethoxyphenyl)heptanoate Openeye Name: methyl 7-(3-benzyloxyphenyl)-7-oxo-6-phenyl-heptanoate CAS Name: 7-oxo-6-phenyl-7-(3-phenylmethoxyphenyl)heptanoic acid methyl ester IUPAC Name: methyl 7-oxo-6-phenyl-7-(3-phenylmethoxyphenyl)heptanoate Traditional Name: 7-(3-benzoxyphenyl)-7-keto-6-phenyl-enanthic acid methyl ester Formula: C27H28O4 MolecularWeight: 416.50882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC(C1=CC=CC=C1)C(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CCCCC(C1=CC=CC=C1)C(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C27H28O4/c1-30-26(28)18-9-8-17-25(22-13-6-3-7-14-22)27(29)23-15-10-16-24(19-23)31-20-21-11-4-2-5-12-21/h2-7,10-16,19,25H,8-9,17-18,20H2,1H3