benzotriazol-1-yl (2S)-5-azanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentanoate

Systemtic Name: benzotriazol-1-yl (2S)-5-azanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentanoate Openeye Name: benzotriazol-1-yl (2S)-5-amino-2-(tert-butoxycarbonylamino)-5-oxo-pentanoate CAS Name: (2S)-5-amino-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxopentanoic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl (2S)-5-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoate Traditional Name: (2S)-5-amino-2-(tert-butoxycarbonylamino)-5-keto-valeric acid benzotriazol-1-yl ester Formula: C16H21N5O5 MolecularWeight: 363.36844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC(=O)N)C(=O)ON1C2=CC=CC=C2N=N1

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCC(=O)N)C(=O)ON1C2=CC=CC=C2N=N1

InChI

InChI=1S/C16H21N5O5/c1-16(2,3)25-15(24)18-11(8-9-13(17)22)14(23)26-21-12-7-5-4-6-10(12)19-20-21/h4-7,11H,8-9H2,1-3H3,(H2,17,22)(H,18,24)/t11-/m0/s1