[3,5-dimethyl-2,6-bis(2-propan-2-ylphenyl)phenyl] (3R,4R)-3-oxidanyl-4-phenyl-pentanoate

Systemtic Name: [3,5-dimethyl-2,6-bis(2-propan-2-ylphenyl)phenyl] (3R,4R)-3-oxidanyl-4-phenyl-pentanoate Openeye Name: [2,6-bis(2-isopropylphenyl)-3,5-dimethyl-phenyl] (3R,4R)-3-hydroxy-4-phenyl-pentanoate CAS Name: (3R,4R)-3-hydroxy-4-phenylpentanoic 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,4R)-3-hydroxy-4-phenylpentanoate Traditional Name: (3R,4R)-3-hydroxy-4-phenyl-valeric acid [3,5-dimethyl-2,6-bis(o-cumenyl)phenyl] ester Formula: C37H42O3 MolecularWeight: 534.72758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C2=CC=CC=C2C(C)C)OC(=O)CC(C(C)C3=CC=CC=C3)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]([C@H](C)C3=CC=CC=C3)O)C4=CC=CC=C4C(C)C)C

InChI

InChI=1S/C37H42O3/c1-23(2)29-17-11-13-19-31(29)35-25(5)21-26(6)36(32-20-14-12-18-30(32)24(3)4)37(35)40-34(39)22-33(38)27(7)28-15-9-8-10-16-28/h8-21,23-24,27,33,38H,22H2,1-7H3/t27-,33-/m1/s1