2-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxy-propanoyl]sulfanylethanoic acid

Systemtic Name: 2-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxy-propanoyl]sulfanylethanoic acid Openeye Name: 2-[(2S)-3-benzyloxy-2-(tert-butoxycarbonylamino)propanoyl]sulfanylacetic acid CAS Name: 2-[[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylmethoxypropyl]thio]acetic acid IUPAC Name: 2-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxypropanoyl]sulfanylacetic acid Traditional Name: 2-[[(2S)-3-benzoxy-2-(tert-butoxycarbonylamino)propanoyl]thio]acetic acid Formula: C17H23NO6S MolecularWeight: 369.43262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(COCC1=CC=CC=C1)C(=O)SCC(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](COCC1=CC=CC=C1)C(=O)SCC(=O)O

InChI

InChI=1S/C17H23NO6S/c1-17(2,3)24-16(22)18-13(15(21)25-11-14(19)20)10-23-9-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3,(H,18,22)(H,19,20)/t13-/m0/s1