[(2R,3S)-2-methyl-1-[(4R,5S)-4-methyl-2-oxidanylidene-5-phenyl-1,3-oxazolidin-3-yl]-1-oxidanylidene-hexan-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [(2R,3S)-2-methyl-1-[(4R,5S)-4-methyl-2-oxidanylidene-5-phenyl-1,3-oxazolidin-3-yl]-1-oxidanylidene-hexan-3-yl] 4-methylbenzenesulfonate Openeye Name: [(1S)-1-[(1R)-1-methyl-2-[(4R,5S)-4-methyl-2-oxo-5-phenyl-oxazolidin-3-yl]-2-oxo-ethyl]butyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R,3S)-2-methyl-1-[(4R,5S)-4-methyl-2-oxo-5-phenyl-3-oxazolidinyl]-1-oxohexan-3-yl] ester IUPAC Name: [(2R,3S)-2-methyl-1-[(4R,5S)-4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-1-oxohexan-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1S)-1-[(1R)-2-keto-2-[(4R,5S)-2-keto-4-methyl-5-phenyl-oxazolidin-3-yl]-1-methyl-ethyl]butyl] ester Formula: C24H29NO6S MolecularWeight: 459.55516

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C)C(=O)N1C(C(OC1=O)C2=CC=CC=C2)C)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC[C@@H]([C@@H](C)C(=O)N1[C@@H]([C@@H](OC1=O)C2=CC=CC=C2)C)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H29NO6S/c1-5-9-21(31-32(28,29)20-14-12-16(2)13-15-20)17(3)23(26)25-18(4)22(30-24(25)27)19-10-7-6-8-11-19/h6-8,10-15,17-18,21-22H,5,9H2,1-4H3/t17-,18-,21+,22-/m1/s1