[(1R,2S,5S)-5-methyl-2-propan-2-yl-cyclohexyl] (2S)-3-oxidanylidene-3-phenyl-2-(phenylmethyl)propanoate

Systemtic Name: [(1R,2S,5S)-5-methyl-2-propan-2-yl-cyclohexyl] (2S)-3-oxidanylidene-3-phenyl-2-(phenylmethyl)propanoate Openeye Name: [(1R,2S,5S)-2-isopropyl-5-methyl-cyclohexyl] (2S)-2-benzyl-3-oxo-3-phenyl-propanoate CAS Name: (2S)-3-oxo-3-phenyl-2-(phenylmethyl)propanoic acid [(1R,2S,5S)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5S)-5-methyl-2-propan-2-ylcyclohexyl] (2S)-2-benzyl-3-oxo-3-phenylpropanoate Traditional Name: (2S)-2-benzyl-3-keto-3-phenyl-propionic acid [(1R,2S,5S)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C26H32O3 MolecularWeight: 392.53048

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(CC2=CC=CC=C2)C(=O)C3=CC=CC=C3)C(C)C

Isomeric SMILES

C[C@H]1CC[C@H]([C@@H](C1)OC(=O)[C@@H](CC2=CC=CC=C2)C(=O)C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C26H32O3/c1-18(2)22-15-14-19(3)16-24(22)29-26(28)23(17-20-10-6-4-7-11-20)25(27)21-12-8-5-9-13-21/h4-13,18-19,22-24H,14-17H2,1-3H3/t19-,22-,23-,24+/m0/s1