[4-[(Z)-5-chloranyl-1-(4-hydroxyphenyl)-2-phenyl-pent-1-enyl]phenyl] 3,3-dimethylbutanoate

Systemtic Name: [4-[(Z)-5-chloranyl-1-(4-hydroxyphenyl)-2-phenyl-pent-1-enyl]phenyl] 3,3-dimethylbutanoate Openeye Name: [4-[(Z)-5-chloro-1-(4-hydroxyphenyl)-2-phenyl-pent-1-enyl]phenyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [4-[(Z)-5-chloro-1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenyl] ester IUPAC Name: [4-[(Z)-5-chloro-1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenyl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [4-[(Z)-5-chloro-1-(4-hydroxyphenyl)-2-phenyl-pent-1-enyl]phenyl] ester Formula: C29H31ClO3 MolecularWeight: 463.00764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OC1=CC=C(C=C1)C(=C(CCCCl)C2=CC=CC=C2)C3=CC=C(C=C3)O

Isomeric SMILES

CC(C)(C)CC(=O)OC1=CC=C(C=C1)/C(=C(/CCCCl)\C2=CC=CC=C2)/C3=CC=C(C=C3)O

InChI

InChI=1S/C29H31ClO3/c1-29(2,3)20-27(32)33-25-17-13-23(14-18-25)28(22-11-15-24(31)16-12-22)26(10-7-19-30)21-8-5-4-6-9-21/h4-6,8-9,11-18,31H,7,10,19-20H2,1-3H3/b28-26-