2-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]-3-sulfanyl-propanoic acid Openeye Name: 2-[benzyl(tert-butoxycarbonyl)amino]-3-sulfanyl-propanoic acid CAS Name: 3-mercapto-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(phenylmethyl)amino]propanoic acid IUPAC Name: 2-[benzyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-sulfanylpropanoic acid Traditional Name: 2-[benzyl(tert-butoxycarbonyl)amino]-3-mercapto-propionic acid Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)C(CS)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)C(CS)C(=O)O

InChI

InChI=1S/C15H21NO4S/c1-15(2,3)20-14(19)16(12(10-21)13(17)18)9-11-7-5-4-6-8-11/h4-8,12,21H,9-10H2,1-3H3,(H,17,18)