(phenylmethyl) 8-(3-oxidanylidenecyclopropen-1-yl)octanoate

Systemtic Name: (phenylmethyl) 8-(3-oxidanylidenecyclopropen-1-yl)octanoate Openeye Name: benzyl 8-(3-oxocyclopropen-1-yl)octanoate CAS Name: 8-(3-oxo-1-cyclopropenyl)octanoic acid (phenylmethyl) ester IUPAC Name: benzyl 8-(3-oxocyclopropen-1-yl)octanoate Traditional Name: 8-(3-ketocyclopropen-1-yl)caprylic acid benzyl ester Formula: C18H22O3 MolecularWeight: 286.36548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCCCCCCC2=CC2=O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCCCCCCC2=CC2=O

InChI

InChI=1S/C18H22O3/c19-17-13-16(17)11-7-2-1-3-8-12-18(20)21-14-15-9-5-4-6-10-15/h4-6,9-10,13H,1-3,7-8,11-12,14H2