dimethyl 3-oxidanylidene-2-(3-phenylmethoxyoctyl)decanedioate

Systemtic Name: dimethyl 3-oxidanylidene-2-(3-phenylmethoxyoctyl)decanedioate Openeye Name: dimethyl 2-(3-benzyloxyoctyl)-3-oxo-decanedioate CAS Name: 3-oxo-2-(3-phenylmethoxyoctyl)decanedioic acid dimethyl ester IUPAC Name: dimethyl 3-oxo-2-(3-phenylmethoxyoctyl)decanedioate Traditional Name: 2-(3-benzoxyoctyl)-3-keto-sebacic acid dimethyl ester Formula: C27H42O6 MolecularWeight: 462.61878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCC(C(=O)CCCCCCC(=O)OC)C(=O)OC)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCC(CCC(C(=O)CCCCCCC(=O)OC)C(=O)OC)OCC1=CC=CC=C1

InChI

InChI=1S/C27H42O6/c1-4-5-9-16-23(33-21-22-14-10-8-11-15-22)19-20-24(27(30)32-3)25(28)17-12-6-7-13-18-26(29)31-2/h8,10-11,14-15,23-24H,4-7,9,12-13,16-21H2,1-3H3