ethyl (2R,3S)-3-bromanyl-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: ethyl (2R,3S)-3-bromanyl-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: ethyl (2R,3S)-3-bromo-3-phenyl-2-(p-tolylsulfonylamino)propanoate CAS Name: (2R,3S)-3-bromo-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2R,3S)-3-bromo-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: (2R,3S)-3-bromo-3-phenyl-2-(tosylamino)propionic acid ethyl ester Formula: C18H20BrNO4S MolecularWeight: 426.3247

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CC=C1)Br)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

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

InChI

InChI=1S/C18H20BrNO4S/c1-3-24-18(21)17(16(19)14-7-5-4-6-8-14)20-25(22,23)15-11-9-13(2)10-12-15/h4-12,16-17,20H,3H2,1-2H3/t16-,17-/m0/s1