tert-butyl 2-[3-(6-methoxyquinolin-4-yl)propyl]-3-(2-oxidanylideneethyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 2-[3-(6-methoxyquinolin-4-yl)propyl]-3-(2-oxidanylideneethyl)piperidine-1-carboxylate Openeye Name: tert-butyl 2-[3-(6-methoxy-4-quinolyl)propyl]-3-(2-oxoethyl)piperidine-1-carboxylate CAS Name: 2-[3-(6-methoxy-4-quinolinyl)propyl]-3-(2-oxoethyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-(6-methoxyquinolin-4-yl)propyl]-3-(2-oxoethyl)piperidine-1-carboxylate Traditional Name: 3-(2-ketoethyl)-2-[3-(6-methoxy-4-quinolyl)propyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H34N2O4 MolecularWeight: 426.54846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1CCCC2=C3C=C(C=CC3=NC=C2)OC)CC=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1CCCC2=C3C=C(C=CC3=NC=C2)OC)CC=O

InChI

InChI=1S/C25H34N2O4/c1-25(2,3)31-24(29)27-15-6-8-19(13-16-28)23(27)9-5-7-18-12-14-26-22-11-10-20(30-4)17-21(18)22/h10-12,14,16-17,19,23H,5-9,13,15H2,1-4H3