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

Systemtic Name: 2-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]sulfanylethanoic acid Openeye Name: 2-[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]sulfanylacetic acid CAS Name: 2-[[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]thio]acetic acid IUPAC Name: 2-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]sulfanylacetic acid Traditional Name: 2-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]thio]acetic acid Formula: C16H21NO5S MolecularWeight: 339.40664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)SCC(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)SCC(=O)O

InChI

InChI=1S/C16H21NO5S/c1-16(2,3)22-15(21)17-12(14(20)23-10-13(18)19)9-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H,17,21)(H,18,19)/t12-/m0/s1