[3,5-dimethyl-2,6-bis(2-propan-2-ylphenyl)phenyl] (3R)-3-cyclohexyl-3-oxidanyl-propanoate

Systemtic Name: [3,5-dimethyl-2,6-bis(2-propan-2-ylphenyl)phenyl] (3R)-3-cyclohexyl-3-oxidanyl-propanoate Openeye Name: [2,6-bis(2-isopropylphenyl)-3,5-dimethyl-phenyl] (3R)-3-cyclohexyl-3-hydroxy-propanoate CAS Name: (3R)-3-cyclohexyl-3-hydroxypropanoic acid [3,5-dimethyl-2,6-bis(2-propan-2-ylphenyl)phenyl] ester IUPAC Name: [3,5-dimethyl-2,6-bis(2-propan-2-ylphenyl)phenyl] (3R)-3-cyclohexyl-3-hydroxypropanoate Traditional Name: (3R)-3-cyclohexyl-3-hydroxy-propionic acid [3,5-dimethyl-2,6-bis(o-cumenyl)phenyl] ester Formula: C35H44O3 MolecularWeight: 512.72206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C2=CC=CC=C2C(C)C)OC(=O)CC(C3CCCCC3)O)C4=CC=CC=C4C(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C2=CC=CC=C2C(C)C)OC(=O)C[C@H](C3CCCCC3)O)C4=CC=CC=C4C(C)C)C

InChI

InChI=1S/C35H44O3/c1-22(2)27-16-10-12-18-29(27)33-24(5)20-25(6)34(30-19-13-11-17-28(30)23(3)4)35(33)38-32(37)21-31(36)26-14-8-7-9-15-26/h10-13,16-20,22-23,26,31,36H,7-9,14-15,21H2,1-6H3/t31-/m1/s1