methyl (E)-5-[(4-methylphenyl)sulfonyl-[(2S)-1-oxidanylpropan-2-yl]amino]pent-2-enoate

Systemtic Name: methyl (E)-5-[(4-methylphenyl)sulfonyl-[(2S)-1-oxidanylpropan-2-yl]amino]pent-2-enoate Openeye Name: methyl (E)-5-[[(1S)-2-hydroxy-1-methyl-ethyl]-(p-tolylsulfonyl)amino]pent-2-enoate CAS Name: (E)-5-[[(2S)-1-hydroxypropan-2-yl]-(4-methylphenyl)sulfonylamino]-2-pentenoic acid methyl ester IUPAC Name: methyl (E)-5-[[(2S)-1-hydroxypropan-2-yl]-(4-methylphenyl)sulfonylamino]pent-2-enoate Traditional Name: (E)-5-[[(1S)-2-hydroxy-1-methyl-ethyl]-tosyl-amino]pent-2-enoic acid methyl ester Formula: C16H23NO5S MolecularWeight: 341.42252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC=CC(=O)OC)C(C)CO

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO5S/c1-13-7-9-15(10-8-13)23(20,21)17(14(2)12-18)11-5-4-6-16(19)22-3/h4,6-10,14,18H,5,11-12H2,1-3H3/b6-4+/t14-/m0/s1