2-[(2S)-3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]sulfanylethanoic acid

Systemtic Name: 2-[(2S)-3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]sulfanylethanoic acid Openeye Name: 2-[(2S)-2-(tert-butoxycarbonylamino)-3-ethoxy-3-oxo-propyl]sulfanylacetic acid CAS Name: 2-[[(2S)-3-ethoxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxopropyl]thio]acetic acid IUPAC Name: 2-[(2S)-3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanylacetic acid Traditional Name: 2-[[(2S)-2-(tert-butoxycarbonylamino)-3-ethoxy-3-keto-propyl]thio]acetic acid Formula: C12H21NO6S MolecularWeight: 307.36324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSCC(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@@H](CSCC(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C12H21NO6S/c1-5-18-10(16)8(6-20-7-9(14)15)13-11(17)19-12(2,3)4/h8H,5-7H2,1-4H3,(H,13,17)(H,14,15)/t8-/m1/s1