[2-[(E)-3-oxidanylidene-3-(4-phenylphenyl)prop-1-enyl]phenyl] 4-methylbenzoate

Systemtic Name: [2-[(E)-3-oxidanylidene-3-(4-phenylphenyl)prop-1-enyl]phenyl] 4-methylbenzoate Openeye Name: [2-[(E)-3-oxo-3-(4-phenylphenyl)prop-1-enyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-[(E)-3-oxo-3-(4-phenylphenyl)prop-1-enyl]phenyl] ester IUPAC Name: [2-[(E)-3-oxo-3-(4-phenylphenyl)prop-1-enyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-[(E)-3-keto-3-(4-phenylphenyl)prop-1-enyl]phenyl] ester Formula: C29H22O3 MolecularWeight: 418.48318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C=CC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2/C=C/C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H22O3/c1-21-11-13-26(14-12-21)29(31)32-28-10-6-5-9-25(28)19-20-27(30)24-17-15-23(16-18-24)22-7-3-2-4-8-22/h2-20H,1H3/b20-19+