heptyl (2Z)-3-oxidanylidene-2-(phenylmethylidene)butanoate

Systemtic Name: heptyl (2Z)-3-oxidanylidene-2-(phenylmethylidene)butanoate Openeye Name: heptyl (2Z)-2-benzylidene-3-oxo-butanoate CAS Name: (2Z)-3-oxo-2-(phenylmethylene)butanoic acid heptyl ester IUPAC Name: heptyl (2Z)-2-benzylidene-3-oxobutanoate Traditional Name: (Z)-2-acetyl-3-phenyl-acrylic acid heptyl ester Formula: C18H24O3 MolecularWeight: 288.38136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C(=CC1=CC=CC=C1)C(=O)C

Isomeric SMILES

CCCCCCCOC(=O)/C(=C\C1=CC=CC=C1)/C(=O)C

InChI

InChI=1S/C18H24O3/c1-3-4-5-6-10-13-21-18(20)17(15(2)19)14-16-11-8-7-9-12-16/h7-9,11-12,14H,3-6,10,13H2,1-2H3/b17-14-