[[(4R,5R)-2,2-dimethyl-5-phenyl-1,3-dioxolan-4-yl]-(4-methylphenyl)sulfanyl-methyl] ethanoate

Systemtic Name: [[(4R,5R)-2,2-dimethyl-5-phenyl-1,3-dioxolan-4-yl]-(4-methylphenyl)sulfanyl-methyl] ethanoate Openeye Name: [[(4R,5R)-2,2-dimethyl-5-phenyl-1,3-dioxolan-4-yl]-(p-tolylsulfanyl)methyl] acetate CAS Name: acetic acid [[(4R,5R)-2,2-dimethyl-5-phenyl-1,3-dioxolan-4-yl]-[(4-methylphenyl)thio]methyl] ester IUPAC Name: [[(4R,5R)-2,2-dimethyl-5-phenyl-1,3-dioxolan-4-yl]-(4-methylphenyl)sulfanylmethyl] acetate Traditional Name: acetic acid [[(4R,5R)-2,2-dimethyl-5-phenyl-1,3-dioxolan-4-yl]-(p-tolylthio)methyl] ester Formula: C21H24O4S MolecularWeight: 372.47786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C2C(OC(O2)(C)C)C3=CC=CC=C3)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SC([C@H]2[C@H](OC(O2)(C)C)C3=CC=CC=C3)OC(=O)C

InChI

InChI=1S/C21H24O4S/c1-14-10-12-17(13-11-14)26-20(23-15(2)22)19-18(24-21(3,4)25-19)16-8-6-5-7-9-16/h5-13,18-20H,1-4H3/t18-,19-,20?/m1/s1