tert-butyl N-[benzotriazol-1-yl-[(2-methylpropan-2-yl)oxycarbonylamino]methyl]carbamate

Systemtic Name: tert-butyl N-[benzotriazol-1-yl-[(2-methylpropan-2-yl)oxycarbonylamino]methyl]carbamate Openeye Name: tert-butyl N-[benzotriazol-1-yl-(tert-butoxycarbonylamino)methyl]carbamate CAS Name: N-[1-benzotriazolyl-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[benzotriazol-1-yl-[(2-methylpropan-2-yl)oxycarbonylamino]methyl]carbamate Traditional Name: N-[benzotriazol-1-yl-(tert-butoxycarbonylamino)methyl]carbamic acid tert-butyl ester Formula: C17H25N5O4 MolecularWeight: 363.4115

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(NC(=O)OC(C)(C)C)N1C2=CC=CC=C2N=N1

Isomeric SMILES

CC(C)(C)OC(=O)NC(NC(=O)OC(C)(C)C)N1C2=CC=CC=C2N=N1

InChI

InChI=1S/C17H25N5O4/c1-16(2,3)25-14(23)18-13(19-15(24)26-17(4,5)6)22-12-10-8-7-9-11(12)20-21-22/h7-10,13H,1-6H3,(H,18,23)(H,19,24)