3-(3-chloranyl-6-methoxy-quinolin-4-yl)propyl 1-heptylpiperidine-4-carboxylate

Systemtic Name: 3-(3-chloranyl-6-methoxy-quinolin-4-yl)propyl 1-heptylpiperidine-4-carboxylate Openeye Name: 3-(3-chloro-6-methoxy-4-quinolyl)propyl 1-heptylpiperidine-4-carboxylate CAS Name: 1-heptyl-4-piperidinecarboxylic acid 3-(3-chloro-6-methoxy-4-quinolinyl)propyl ester IUPAC Name: 3-(3-chloro-6-methoxyquinolin-4-yl)propyl 1-heptylpiperidine-4-carboxylate Traditional Name: 1-heptylisonipecotic acid 3-(3-chloro-6-methoxy-4-quinolyl)propyl ester Formula: C26H37ClN2O3 MolecularWeight: 461.03658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1CCC(CC1)C(=O)OCCCC2=C3C=C(C=CC3=NC=C2Cl)OC

Isomeric SMILES

CCCCCCCN1CCC(CC1)C(=O)OCCCC2=C3C=C(C=CC3=NC=C2Cl)OC

InChI

InChI=1S/C26H37ClN2O3/c1-3-4-5-6-7-14-29-15-12-20(13-16-29)26(30)32-17-8-9-22-23-18-21(31-2)10-11-25(23)28-19-24(22)27/h10-11,18-20H,3-9,12-17H2,1-2H3