phenethyl 3-[(E)-3-(4-methylphenyl)prop-2-enoyl]oxybenzoate

Systemtic Name: phenethyl 3-[(E)-3-(4-methylphenyl)prop-2-enoyl]oxybenzoate Openeye Name: phenethyl 3-[(E)-3-(p-tolyl)prop-2-enoyl]oxybenzoate CAS Name: 3-[(E)-3-(4-methylphenyl)-1-oxoprop-2-enoxy]benzoic acid phenethyl ester IUPAC Name: phenethyl 3-[(E)-3-(4-methylphenyl)prop-2-enoyl]oxybenzoate Traditional Name: 3-[(E)-3-(p-tolyl)acryloyl]oxybenzoic acid phenethyl ester Formula: C25H22O4 MolecularWeight: 386.43978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)OC2=CC=CC(=C2)C(=O)OCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)OC2=CC=CC(=C2)C(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C25H22O4/c1-19-10-12-21(13-11-19)14-15-24(26)29-23-9-5-8-22(18-23)25(27)28-17-16-20-6-3-2-4-7-20/h2-15,18H,16-17H2,1H3/b15-14+