[2-[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]phenyl] 4-methylbenzoate

Systemtic Name: [2-[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]phenyl] 4-methylbenzoate Openeye Name: [2-[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-[(E)-3-(4-tert-butylphenyl)-1-oxoprop-2-enyl]phenyl] ester IUPAC Name: [2-[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-[(E)-3-(4-tert-butylphenyl)acryloyl]phenyl] ester Formula: C27H26O3 MolecularWeight: 398.49354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C(=O)C=CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

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

InChI

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