[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] naphthalene-2-sulfinate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] naphthalene-2-sulfinate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] naphthalene-2-sulfinate CAS Name: 2-naphthalenesulfinic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] naphthalene-2-sulfinate Traditional Name: naphthalene-2-sulfinic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C20H26O2S MolecularWeight: 330.48424

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OS(=O)C2=CC3=CC=CC=C3C=C2)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)O[S@@](=O)C2=CC3=CC=CC=C3C=C2)C(C)C

InChI

InChI=1S/C20H26O2S/c1-14(2)19-11-8-15(3)12-20(19)22-23(21)18-10-9-16-6-4-5-7-17(16)13-18/h4-7,9-10,13-15,19-20H,8,11-12H2,1-3H3/t15-,19+,20-,23-/m1/s1