[(1R)-1-phenylprop-2-ynyl] (2S)-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: [(1R)-1-phenylprop-2-ynyl] (2S)-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: [(1R)-1-phenylprop-2-ynyl] (2S)-3-phenyl-2-(p-tolylsulfonylamino)propanoate CAS Name: (2S)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid [(1R)-1-phenylprop-2-ynyl] ester IUPAC Name: [(1R)-1-phenylprop-2-ynyl] (2S)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: (2S)-3-phenyl-2-(tosylamino)propionic acid [(1R)-1-phenylprop-2-ynyl] ester Formula: C25H23NO4S MolecularWeight: 433.51942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)OC(C#C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O[C@H](C#C)C3=CC=CC=C3

InChI

InChI=1S/C25H23NO4S/c1-3-24(21-12-8-5-9-13-21)30-25(27)23(18-20-10-6-4-7-11-20)26-31(28,29)22-16-14-19(2)15-17-22/h1,4-17,23-24,26H,18H2,2H3/t23-,24+/m0/s1