dipropan-2-yl (2S,3S)-2-oxidanyl-3-phenylsulfanyl-butanedioate

Systemtic Name: dipropan-2-yl (2S,3S)-2-oxidanyl-3-phenylsulfanyl-butanedioate Openeye Name: diisopropyl (2S,3S)-2-hydroxy-3-phenylsulfanyl-butanedioate CAS Name: (2S,3S)-2-hydroxy-3-(phenylthio)butanedioic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl (2S,3S)-2-hydroxy-3-phenylsulfanylbutanedioate Traditional Name: (2S,3S)-2-hydroxy-3-(phenylthio)succinic acid diisopropyl ester Formula: C16H22O5S MolecularWeight: 326.40788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C(C(=O)OC(C)C)SC1=CC=CC=C1)O

Isomeric SMILES

CC(C)OC(=O)[C@@H]([C@@H](C(=O)OC(C)C)SC1=CC=CC=C1)O

InChI

InChI=1S/C16H22O5S/c1-10(2)20-15(18)13(17)14(16(19)21-11(3)4)22-12-8-6-5-7-9-12/h5-11,13-14,17H,1-4H3/t13-,14+/m1/s1