tert-butyl 2-(benzotriazol-1-yl)azepane-1-carboxylate

Systemtic Name: tert-butyl 2-(benzotriazol-1-yl)azepane-1-carboxylate Openeye Name: tert-butyl 2-(benzotriazol-1-yl)azepane-1-carboxylate CAS Name: 2-(1-benzotriazolyl)-1-azepanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(benzotriazol-1-yl)azepane-1-carboxylate Traditional Name: 2-(benzotriazol-1-yl)azepane-1-carboxylic acid tert-butyl ester Formula: C17H24N4O2 MolecularWeight: 316.39806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCCC1N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCCCC1N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H24N4O2/c1-17(2,3)23-16(22)20-12-8-4-5-11-15(20)21-14-10-7-6-9-13(14)18-19-21/h6-7,9-10,15H,4-5,8,11-12H2,1-3H3