methyl (2S,3S)-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-butanoate

Systemtic Name: methyl (2S,3S)-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-butanoate Openeye Name: methyl (2S,3S)-3-phenyl-2-(p-tolylsulfonylamino)butanoate CAS Name: (2S,3S)-2-[(4-methylphenyl)sulfonylamino]-3-phenylbutanoic acid methyl ester IUPAC Name: methyl (2S,3S)-2-[(4-methylphenyl)sulfonylamino]-3-phenylbutanoate Traditional Name: (2S,3S)-3-phenyl-2-(tosylamino)butyric acid methyl ester Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H]([C@@H](C)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C18H21NO4S/c1-13-9-11-16(12-10-13)24(21,22)19-17(18(20)23-3)14(2)15-7-5-4-6-8-15/h4-12,14,17,19H,1-3H3/t14-,17-/m0/s1