[(1S,3S)-4,4-dimethyl-3-oxidanyl-1-phenyl-pentyl] benzoate

Systemtic Name: [(1S,3S)-4,4-dimethyl-3-oxidanyl-1-phenyl-pentyl] benzoate Openeye Name: [(1S,3S)-3-hydroxy-4,4-dimethyl-1-phenyl-pentyl] benzoate CAS Name: benzoic acid [(1S,3S)-3-hydroxy-4,4-dimethyl-1-phenylpentyl] ester IUPAC Name: [(1S,3S)-3-hydroxy-4,4-dimethyl-1-phenylpentyl] benzoate Traditional Name: benzoic acid [(1S,3S)-3-hydroxy-4,4-dimethyl-1-phenyl-pentyl] ester Formula: C20H24O3 MolecularWeight: 312.40276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CC(C1=CC=CC=C1)OC(=O)C2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)[C@H](C[C@@H](C1=CC=CC=C1)OC(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C20H24O3/c1-20(2,3)18(21)14-17(15-10-6-4-7-11-15)23-19(22)16-12-8-5-9-13-16/h4-13,17-18,21H,14H2,1-3H3/t17-,18-/m0/s1