methyl (4S)-4-methyl-4-[(1S)-1-oxidanyl-4-phenylmethoxy-butyl]cyclohex-2-ene-1-carboxylate

Systemtic Name: methyl (4S)-4-methyl-4-[(1S)-1-oxidanyl-4-phenylmethoxy-butyl]cyclohex-2-ene-1-carboxylate Openeye Name: methyl (4S)-4-[(1S)-4-benzyloxy-1-hydroxy-butyl]-4-methyl-cyclohex-2-ene-1-carboxylate CAS Name: (4S)-4-[(1S)-1-hydroxy-4-phenylmethoxybutyl]-4-methyl-1-cyclohex-2-enecarboxylic acid methyl ester IUPAC Name: methyl (4S)-4-[(1S)-1-hydroxy-4-phenylmethoxybutyl]-4-methylcyclohex-2-ene-1-carboxylate Traditional Name: (4S)-4-[(1S)-4-benzoxy-1-hydroxy-butyl]-4-methyl-cyclohex-2-ene-1-carboxylic acid methyl ester Formula: C20H28O4 MolecularWeight: 332.43392

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C=C1)C(=O)OC)C(CCCOCC2=CC=CC=C2)O

Isomeric SMILES

C[C@@]1(CCC(C=C1)C(=O)OC)[C@H](CCCOCC2=CC=CC=C2)O

InChI

InChI=1S/C20H28O4/c1-20(12-10-17(11-13-20)19(22)23-2)18(21)9-6-14-24-15-16-7-4-3-5-8-16/h3-5,7-8,10,12,17-18,21H,6,9,11,13-15H2,1-2H3/t17?,18-,20+/m0/s1