[2-[(1E)-hexa-1,5-dienyl]phenyl] 4-propylbenzoate

Systemtic Name: [2-[(1E)-hexa-1,5-dienyl]phenyl] 4-propylbenzoate Openeye Name: [2-[(1E)-hexa-1,5-dienyl]phenyl] 4-propylbenzoate CAS Name: 4-propylbenzoic acid [2-[(1E)-hexa-1,5-dienyl]phenyl] ester IUPAC Name: [2-[(1E)-hexa-1,5-dienyl]phenyl] 4-propylbenzoate Traditional Name: 4-propylbenzoic acid [2-[(1E)-hexa-1,5-dienyl]phenyl] ester Formula: C22H24O2 MolecularWeight: 320.42476

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C=CCCC=C

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2/C=C/CCC=C

InChI

InChI=1S/C22H24O2/c1-3-5-6-7-11-19-12-8-9-13-21(19)24-22(23)20-16-14-18(10-4-2)15-17-20/h3,7-9,11-17H,1,4-6,10H2,2H3/b11-7+