(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-(tert-butoxycarbonylamino)butanoate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Traditional Name: 4-(tert-butoxycarbonylamino)butyric acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C17H22N4O5 MolecularWeight: 362.38038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCC(=O)OCN1C(=O)C2=CC=CC=C2N=N1

Isomeric SMILES

CC(C)(C)OC(=O)NCCCC(=O)OCN1C(=O)C2=CC=CC=C2N=N1

InChI

InChI=1S/C17H22N4O5/c1-17(2,3)26-16(24)18-10-6-9-14(22)25-11-21-15(23)12-7-4-5-8-13(12)19-20-21/h4-5,7-8H,6,9-11H2,1-3H3,(H,18,24)