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

Systemtic Name: tert-butyl 4-[7-chloranyl-2-(2-methoxyethylamino)quinolin-4-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[7-chloro-2-(2-methoxyethylamino)-4-quinolyl]piperazine-1-carboxylate CAS Name: 4-[7-chloro-2-(2-methoxyethylamino)-4-quinolinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[7-chloro-2-(2-methoxyethylamino)quinolin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[7-chloro-2-(2-methoxyethylamino)-4-quinolyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C21H29ClN4O3 MolecularWeight: 420.93296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29ClN4O3/c1-21(2,3)29-20(27)26-10-8-25(9-11-26)18-14-19(23-7-12-28-4)24-17-13-15(22)5-6-16(17)18/h5-6,13-14H,7-12H2,1-4H3,(H,23,24)