phenyl 6-oxidanylideneheptanoate

Systemtic Name: phenyl 6-oxidanylideneheptanoate Openeye Name: phenyl 6-oxoheptanoate CAS Name: 6-oxoheptanoic acid phenyl ester IUPAC Name: phenyl 6-oxoheptanoate Traditional Name: 6-ketoenanthic acid phenyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCCC(=O)OC1=CC=CC=C1

Isomeric SMILES

CC(=O)CCCCC(=O)OC1=CC=CC=C1

InChI

InChI=1S/C13H16O3/c1-11(14)7-5-6-10-13(15)16-12-8-3-2-4-9-12/h2-4,8-9H,5-7,10H2,1H3