2-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-oxidanyl-methyl]-3-phenylsulfanyl-cyclohexan-1-one

Systemtic Name: 2-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-oxidanyl-methyl]-3-phenylsulfanyl-cyclohexan-1-one Openeye Name: 2-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-hydroxy-methyl]-3-phenylsulfanyl-cyclohexanone CAS Name: 2-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-hydroxymethyl]-3-(phenylthio)-1-cyclohexanone IUPAC Name: 2-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-hydroxymethyl]-3-phenylsulfanylcyclohexan-1-one Traditional Name: 2-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-hydroxy-methyl]-3-(phenylthio)cyclohexanone Formula: C18H24O4S MolecularWeight: 336.44576

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)C(C2C(CCCC2=O)SC3=CC=CC=C3)O)C

Isomeric SMILES

CC1(OC[C@H](O1)C(C2C(CCCC2=O)SC3=CC=CC=C3)O)C

InChI

InChI=1S/C18H24O4S/c1-18(2)21-11-14(22-18)17(20)16-13(19)9-6-10-15(16)23-12-7-4-3-5-8-12/h3-5,7-8,14-17,20H,6,9-11H2,1-2H3/t14-,15?,16?,17?/m0/s1