octyl (2R,3S)-2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-3-phenyl-propanoate

Systemtic Name: octyl (2R,3S)-2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-3-phenyl-propanoate Openeye Name: octyl (2R,3S)-3-hydroxy-3-phenyl-2-(p-tolylsulfonylamino)propanoate CAS Name: (2R,3S)-3-hydroxy-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid octyl ester IUPAC Name: octyl (2R,3S)-3-hydroxy-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: (2R,3S)-3-hydroxy-3-phenyl-2-(tosylamino)propionic acid octyl ester Formula: C24H33NO5S MolecularWeight: 447.58752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(C(C1=CC=CC=C1)O)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCOC(=O)[C@@H]([C@H](C1=CC=CC=C1)O)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C24H33NO5S/c1-3-4-5-6-7-11-18-30-24(27)22(23(26)20-12-9-8-10-13-20)25-31(28,29)21-16-14-19(2)15-17-21/h8-10,12-17,22-23,25-26H,3-7,11,18H2,1-2H3/t22-,23+/m1/s1