tert-butyl 4-[7-chloranyl-2-(cyclohexylamino)quinolin-4-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[7-chloranyl-2-(cyclohexylamino)quinolin-4-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[7-chloro-2-(cyclohexylamino)-4-quinolyl]piperazine-1-carboxylate CAS Name: 4-[7-chloro-2-(cyclohexylamino)-4-quinolinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[7-chloro-2-(cyclohexylamino)quinolin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[7-chloro-2-(cyclohexylamino)-4-quinolyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H33ClN4O2 MolecularWeight: 444.99742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=NC3=C2C=CC(=C3)Cl)NC4CCCCC4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=NC3=C2C=CC(=C3)Cl)NC4CCCCC4

InChI

InChI=1S/C24H33ClN4O2/c1-24(2,3)31-23(30)29-13-11-28(12-14-29)21-16-22(26-18-7-5-4-6-8-18)27-20-15-17(25)9-10-19(20)21/h9-10,15-16,18H,4-8,11-14H2,1-3H3,(H,26,27)