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

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl) 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]benzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl) 4-[(tert-butoxycarbonylamino)methyl]benzoate CAS Name: 4-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]benzoic acid (4-oxo-1,2,3-benzotriazin-3-yl) ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl) 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]benzoate Traditional Name: 4-[(tert-butoxycarbonylamino)methyl]benzoic acid (4-keto-1,2,3-benzotriazin-3-yl) ester Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)ON2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)ON2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C20H20N4O5/c1-20(2,3)28-19(27)21-12-13-8-10-14(11-9-13)18(26)29-24-17(25)15-6-4-5-7-16(15)22-23-24/h4-11H,12H2,1-3H3,(H,21,27)