ethyl (2R,3S)-2-benzamido-3-(4-methylsulfonylphenyl)-3-oxidanyl-propanoate

Systemtic Name: ethyl (2R,3S)-2-benzamido-3-(4-methylsulfonylphenyl)-3-oxidanyl-propanoate Openeye Name: ethyl (2R,3S)-2-benzamido-3-hydroxy-3-(4-methylsulfonylphenyl)propanoate CAS Name: (2R,3S)-2-benzamido-3-hydroxy-3-(4-methylsulfonylphenyl)propanoic acid ethyl ester IUPAC Name: ethyl (2R,3S)-2-benzamido-3-hydroxy-3-(4-methylsulfonylphenyl)propanoate Traditional Name: (2R,3S)-2-benzamido-3-hydroxy-3-(4-mesylphenyl)propionic acid ethyl ester Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=C(C=C1)S(=O)(=O)C)O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@@H]([C@H](C1=CC=C(C=C1)S(=O)(=O)C)O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H21NO6S/c1-3-26-19(23)16(20-18(22)14-7-5-4-6-8-14)17(21)13-9-11-15(12-10-13)27(2,24)25/h4-12,16-17,21H,3H2,1-2H3,(H,20,22)/t16-,17+/m1/s1