tert-butyl 4-[(1-chloranylisoquinolin-5-yl)amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(1-chloranylisoquinolin-5-yl)amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(1-chloro-5-isoquinolyl)amino]piperidine-1-carboxylate CAS Name: 4-[(1-chloro-5-isoquinolinyl)amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(1-chloroisoquinolin-5-yl)amino]piperidine-1-carboxylate Traditional Name: 4-[(1-chloro-5-isoquinolyl)amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H24ClN3O2 MolecularWeight: 361.86576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)NC2=CC=CC3=C2C=CN=C3Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)NC2=CC=CC3=C2C=CN=C3Cl

InChI

InChI=1S/C19H24ClN3O2/c1-19(2,3)25-18(24)23-11-8-13(9-12-23)22-16-6-4-5-15-14(16)7-10-21-17(15)20/h4-7,10,13,22H,8-9,11-12H2,1-3H3