octyl 3-oxidanylidene-2-phenyl-undecanoate

Systemtic Name: octyl 3-oxidanylidene-2-phenyl-undecanoate Openeye Name: octyl 3-oxo-2-phenyl-undecanoate CAS Name: 3-oxo-2-phenylundecanoic acid octyl ester IUPAC Name: octyl 3-oxo-2-phenylundecanoate Traditional Name: 3-keto-2-phenyl-undecanoic acid octyl ester Formula: C25H40O3 MolecularWeight: 388.5833

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)C(C1=CC=CC=C1)C(=O)OCCCCCCCC

Isomeric SMILES

CCCCCCCCC(=O)C(C1=CC=CC=C1)C(=O)OCCCCCCCC

InChI

InChI=1S/C25H40O3/c1-3-5-7-9-11-16-20-23(26)24(22-18-14-13-15-19-22)25(27)28-21-17-12-10-8-6-4-2/h13-15,18-19,24H,3-12,16-17,20-21H2,1-2H3