(2S,3S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(2-methylsulfonyloxyethyl)pent-4-enoic acid

Systemtic Name: (2S,3S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(2-methylsulfonyloxyethyl)pent-4-enoic acid Openeye Name: (2S,3S)-2-(tert-butoxycarbonylamino)-3-(2-methylsulfonyloxyethyl)pent-4-enoic acid CAS Name: (2S,3S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(2-methylsulfonyloxyethyl)-4-pentenoic acid IUPAC Name: (2S,3S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(2-methylsulfonyloxyethyl)pent-4-enoic acid Traditional Name: (2S,3S)-2-(tert-butoxycarbonylamino)-3-(2-methylsulfonyloxyethyl)pent-4-enoic acid Formula: C13H23NO7S MolecularWeight: 337.38922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C(CCOS(=O)(=O)C)C=C)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]([C@@H](CCOS(=O)(=O)C)C=C)C(=O)O

InChI

InChI=1S/C13H23NO7S/c1-6-9(7-8-20-22(5,18)19)10(11(15)16)14-12(17)21-13(2,3)4/h6,9-10H,1,7-8H2,2-5H3,(H,14,17)(H,15,16)/t9-,10+/m1/s1