benzotriazol-1-yl 1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]imidazole-2-carboxylate

Systemtic Name: benzotriazol-1-yl 1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]imidazole-2-carboxylate Openeye Name: benzotriazol-1-yl 4-(tert-butoxycarbonylamino)-1-methyl-imidazole-2-carboxylate CAS Name: 1-methyl-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-imidazolecarboxylic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl 1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]imidazole-2-carboxylate Traditional Name: 4-(tert-butoxycarbonylamino)-1-methyl-imidazole-2-carboxylic acid benzotriazol-1-yl ester Formula: C16H18N6O4 MolecularWeight: 358.35192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CN(C(=N1)C(=O)ON2C3=CC=CC=C3N=N2)C

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CN(C(=N1)C(=O)ON2C3=CC=CC=C3N=N2)C

InChI

InChI=1S/C16H18N6O4/c1-16(2,3)25-15(24)18-12-9-21(4)13(17-12)14(23)26-22-11-8-6-5-7-10(11)19-20-22/h5-9H,1-4H3,(H,18,24)