11-phenylundec-10-ynyl 10-oxidanylidenedecanoate

Systemtic Name: 11-phenylundec-10-ynyl 10-oxidanylidenedecanoate Openeye Name: 11-phenylundec-10-ynyl 10-oxodecanoate CAS Name: 10-oxodecanoic acid 11-phenylundec-10-ynyl ester IUPAC Name: 11-phenylundec-10-ynyl 10-oxodecanoate Traditional Name: 10-ketocapric acid 11-phenylundec-10-ynyl ester Formula: C27H40O3 MolecularWeight: 412.6047

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CCCCCCCCCCOC(=O)CCCCCCCCC=O

Isomeric SMILES

C1=CC=C(C=C1)C#CCCCCCCCCCOC(=O)CCCCCCCCC=O

InChI

InChI=1S/C27H40O3/c28-24-18-11-7-4-6-10-17-23-27(29)30-25-19-12-8-3-1-2-5-9-14-20-26-21-15-13-16-22-26/h13,15-16,21-22,24H,1-12,17-19,23,25H2