tert-butyl 4-(2-chloranyl-3-ethyl-quinolin-6-yl)carbonylpiperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-chloranyl-3-ethyl-quinolin-6-yl)carbonylpiperidine-1-carboxylate Openeye Name: tert-butyl 4-(2-chloro-3-ethyl-quinoline-6-carbonyl)piperidine-1-carboxylate CAS Name: 4-[(2-chloro-3-ethyl-6-quinolinyl)-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-chloro-3-ethylquinoline-6-carbonyl)piperidine-1-carboxylate Traditional Name: 4-(2-chloro-3-ethyl-quinoline-6-carbonyl)piperidine-1-carboxylic acid tert-butyl ester Formula: C22H27ClN2O3 MolecularWeight: 402.91438

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=CC(=CC2=C1)C(=O)C3CCN(CC3)C(=O)OC(C)(C)C)Cl

Isomeric SMILES

CCC1=C(N=C2C=CC(=CC2=C1)C(=O)C3CCN(CC3)C(=O)OC(C)(C)C)Cl

InChI

InChI=1S/C22H27ClN2O3/c1-5-14-12-17-13-16(6-7-18(17)24-20(14)23)19(26)15-8-10-25(11-9-15)21(27)28-22(2,3)4/h6-7,12-13,15H,5,8-11H2,1-4H3