phenethyl (E)-3-[3-[(E)-3-oxidanylidene-3-phenethyloxy-prop-1-enyl]cyclopentyl]prop-2-enoate

Systemtic Name: phenethyl (E)-3-[3-[(E)-3-oxidanylidene-3-phenethyloxy-prop-1-enyl]cyclopentyl]prop-2-enoate Openeye Name: phenethyl (E)-3-[3-[(E)-3-oxo-3-phenethyloxy-prop-1-enyl]cyclopentyl]prop-2-enoate CAS Name: (E)-3-[3-[(E)-3-oxo-3-phenethyloxyprop-1-enyl]cyclopentyl]-2-propenoic acid phenethyl ester IUPAC Name: phenethyl (E)-3-[3-[(E)-3-oxo-3-phenethyloxyprop-1-enyl]cyclopentyl]prop-2-enoate Traditional Name: (E)-3-[3-[(E)-3-keto-3-phenethyloxy-prop-1-enyl]cyclopentyl]acrylic acid phenethyl ester Formula: C27H30O4 MolecularWeight: 418.5247

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC1C=CC(=O)OCCC2=CC=CC=C2)C=CC(=O)OCCC3=CC=CC=C3

Isomeric SMILES

C1C(CC(C1)/C=C/C(=O)OCCC2=CC=CC=C2)/C=C/C(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C27H30O4/c28-26(30-19-17-22-7-3-1-4-8-22)15-13-24-11-12-25(21-24)14-16-27(29)31-20-18-23-9-5-2-6-10-23/h1-10,13-16,24-25H,11-12,17-21H2/b15-13+,16-14+