tert-butyl 4-(6-chloranylbenzotriazol-1-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(6-chloranylbenzotriazol-1-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(6-chlorobenzotriazol-1-yl)piperidine-1-carboxylate CAS Name: 4-(6-chloro-1-benzotriazolyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-chlorobenzotriazol-1-yl)piperidine-1-carboxylate Traditional Name: 4-(6-chlorobenzotriazol-1-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C16H21ClN4O2 MolecularWeight: 336.81654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N2C3=C(C=CC(=C3)Cl)N=N2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2C3=C(C=CC(=C3)Cl)N=N2

InChI

InChI=1S/C16H21ClN4O2/c1-16(2,3)23-15(22)20-8-6-12(7-9-20)21-14-10-11(17)4-5-13(14)18-19-21/h4-5,10,12H,6-9H2,1-3H3