methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonyl-phenylmethoxycarbonyl-amino]-3-(1,2,4-triazol-1-yl)propanoate

Systemtic Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonyl-phenylmethoxycarbonyl-amino]-3-(1,2,4-triazol-1-yl)propanoate Openeye Name: methyl (2S)-2-[benzyloxycarbonyl(tert-butoxycarbonyl)amino]-3-(1,2,4-triazol-1-yl)propanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-phenylmethoxycarbonylamino]-3-(1,2,4-triazol-1-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonyl-phenylmethoxycarbonylamino]-3-(1,2,4-triazol-1-yl)propanoate Traditional Name: (2S)-2-[tert-butoxycarbonyl(carbobenzoxy)amino]-3-(1,2,4-triazol-1-yl)propionic acid methyl ester Formula: C19H24N4O6 MolecularWeight: 404.41706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C(CN1C=NC=N1)C(=O)OC)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N([C@@H](CN1C=NC=N1)C(=O)OC)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H24N4O6/c1-19(2,3)29-18(26)23(17(25)28-11-14-8-6-5-7-9-14)15(16(24)27-4)10-22-13-20-12-21-22/h5-9,12-13,15H,10-11H2,1-4H3/t15-/m0/s1