(4-pentylphenyl)methyl 2-oxidanyl-2-phenyl-hex-5-enoate

Systemtic Name: (4-pentylphenyl)methyl 2-oxidanyl-2-phenyl-hex-5-enoate Openeye Name: (4-pentylphenyl)methyl 2-hydroxy-2-phenyl-hex-5-enoate CAS Name: 2-hydroxy-2-phenyl-5-hexenoic acid (4-pentylphenyl)methyl ester IUPAC Name: (4-pentylphenyl)methyl 2-hydroxy-2-phenylhex-5-enoate Traditional Name: 2-hydroxy-2-phenyl-hex-5-enoic acid (4-amylbenzyl) ester Formula: C24H30O3 MolecularWeight: 366.4932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)COC(=O)C(CCC=C)(C2=CC=CC=C2)O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)COC(=O)C(CCC=C)(C2=CC=CC=C2)O

InChI

InChI=1S/C24H30O3/c1-3-5-8-11-20-14-16-21(17-15-20)19-27-23(25)24(26,18-6-4-2)22-12-9-7-10-13-22/h4,7,9-10,12-17,26H,2-3,5-6,8,11,18-19H2,1H3