O1-tert-butyl O4-[(2-chloranylquinolin-3-yl)methyl] piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-[(2-chloranylquinolin-3-yl)methyl] piperidine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-[(2-chloro-3-quinolyl)methyl] piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[(2-chloro-3-quinolinyl)methyl] ester IUPAC Name: 1-O-tert-butyl 4-O-[(2-chloroquinolin-3-yl)methyl] piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[(2-chloro-3-quinolyl)methyl] ester Formula: C21H25ClN2O4 MolecularWeight: 404.8872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)OCC2=CC3=CC=CC=C3N=C2Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)OCC2=CC3=CC=CC=C3N=C2Cl

InChI

InChI=1S/C21H25ClN2O4/c1-21(2,3)28-20(26)24-10-8-14(9-11-24)19(25)27-13-16-12-15-6-4-5-7-17(15)23-18(16)22/h4-7,12,14H,8-11,13H2,1-3H3