[2-[(E)-3-(4-methylphenyl)-3-oxidanylidene-prop-1-enyl]phenyl] 4-tert-butylbenzoate

Systemtic Name: [2-[(E)-3-(4-methylphenyl)-3-oxidanylidene-prop-1-enyl]phenyl] 4-tert-butylbenzoate Openeye Name: [2-[(E)-3-oxo-3-(p-tolyl)prop-1-enyl]phenyl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [2-[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [2-[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]phenyl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [2-[(E)-3-keto-3-(p-tolyl)prop-1-enyl]phenyl] ester Formula: C27H26O3 MolecularWeight: 398.49354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=CC2=CC=CC=C2OC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C/C2=CC=CC=C2OC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H26O3/c1-19-9-11-20(12-10-19)24(28)18-15-21-7-5-6-8-25(21)30-26(29)22-13-16-23(17-14-22)27(2,3)4/h5-18H,1-4H3/b18-15+