tert-butyl 4-(5-chloranylbenzotriazol-2-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(5-chloranylbenzotriazol-2-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(5-chlorobenzotriazol-2-yl)piperidine-1-carboxylate CAS Name: 4-(5-chloro-2-benzotriazolyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-chlorobenzotriazol-2-yl)piperidine-1-carboxylate Traditional Name: 4-(5-chlorobenzotriazol-2-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)N2N=C3C=CC(=CC3=N2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2N=C3C=CC(=CC3=N2)Cl

InChI

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