[(2E)-2-(phenylmethylidene)heptyl] ethanoate

Systemtic Name: [(2E)-2-(phenylmethylidene)heptyl] ethanoate Openeye Name: [(2E)-2-benzylideneheptyl] acetate CAS Name: acetic acid [(2E)-2-(phenylmethylene)heptyl] ester IUPAC Name: [(2E)-2-benzylideneheptyl] acetate Traditional Name: acetic acid [(E)-2-amyl-3-phenyl-allyl] ester Formula: C16H22O2 MolecularWeight: 246.34468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CC1=CC=CC=C1)COC(=O)C

Isomeric SMILES

CCCCC/C(=C\C1=CC=CC=C1)/COC(=O)C

InChI

InChI=1S/C16H22O2/c1-3-4-6-11-16(13-18-14(2)17)12-15-9-7-5-8-10-15/h5,7-10,12H,3-4,6,11,13H2,1-2H3/b16-12+