ethyl 1-[3-[(cyclopentylamino)methyl]-6,7-dimethoxy-quinolin-2-yl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-[(cyclopentylamino)methyl]-6,7-dimethoxy-quinolin-2-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-[(cyclopentylamino)methyl]-6,7-dimethoxy-2-quinolyl]piperidine-3-carboxylate CAS Name: 1-[3-[(cyclopentylamino)methyl]-6,7-dimethoxy-2-quinolinyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(cyclopentylamino)methyl]-6,7-dimethoxyquinolin-2-yl]piperidine-3-carboxylate Traditional Name: 1-[3-[(cyclopentylamino)methyl]-6,7-dimethoxy-2-quinolyl]nipecotic acid ethyl ester Formula: C25H35N3O4 MolecularWeight: 441.5631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=C(C=C3C=C(C(=CC3=N2)OC)OC)CNC4CCCC4

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2=C(C=C3C=C(C(=CC3=N2)OC)OC)CNC4CCCC4

InChI

InChI=1S/C25H35N3O4/c1-4-32-25(29)17-8-7-11-28(16-17)24-19(15-26-20-9-5-6-10-20)12-18-13-22(30-2)23(31-3)14-21(18)27-24/h12-14,17,20,26H,4-11,15-16H2,1-3H3