tert-butyl 4-[(2-chloranyl-7-methoxy-quinolin-3-yl)methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(2-chloranyl-7-methoxy-quinolin-3-yl)methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(2-chloro-7-methoxy-3-quinolyl)methyl]piperazine-1-carboxylate CAS Name: 4-[(2-chloro-7-methoxy-3-quinolinyl)methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2-chloro-7-methoxyquinolin-3-yl)methyl]piperazine-1-carboxylate Traditional Name: 4-[(2-chloro-7-methoxy-3-quinolyl)methyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C20H26ClN3O3 MolecularWeight: 391.89174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC2=C(N=C3C=C(C=CC3=C2)OC)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC2=C(N=C3C=C(C=CC3=C2)OC)Cl

InChI

InChI=1S/C20H26ClN3O3/c1-20(2,3)27-19(25)24-9-7-23(8-10-24)13-15-11-14-5-6-16(26-4)12-17(14)22-18(15)21/h5-6,11-12H,7-10,13H2,1-4H3