4-[3-[3-(dimethylamino)-6-methoxy-quinolin-4-yl]propyl]-1-(3-phenylpropyl)piperidine-4-carboxylic acid

Systemtic Name: 4-[3-[3-(dimethylamino)-6-methoxy-quinolin-4-yl]propyl]-1-(3-phenylpropyl)piperidine-4-carboxylic acid Openeye Name: 4-[3-[3-(dimethylamino)-6-methoxy-4-quinolyl]propyl]-1-(3-phenylpropyl)piperidine-4-carboxylic acid CAS Name: 4-[3-[3-(dimethylamino)-6-methoxy-4-quinolinyl]propyl]-1-(3-phenylpropyl)-4-piperidinecarboxylic acid IUPAC Name: 4-[3-[3-(dimethylamino)-6-methoxyquinolin-4-yl]propyl]-1-(3-phenylpropyl)piperidine-4-carboxylic acid Traditional Name: 4-[3-[3-(dimethylamino)-6-methoxy-4-quinolyl]propyl]-1-(3-phenylpropyl)isonipecotic acid Formula: C30H39N3O3 MolecularWeight: 489.64896

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CN=C2C=CC(=CC2=C1CCCC3(CCN(CC3)CCCC4=CC=CC=C4)C(=O)O)OC

Isomeric SMILES

CN(C)C1=CN=C2C=CC(=CC2=C1CCCC3(CCN(CC3)CCCC4=CC=CC=C4)C(=O)O)OC

InChI

InChI=1S/C30H39N3O3/c1-32(2)28-22-31-27-14-13-24(36-3)21-26(27)25(28)12-7-15-30(29(34)35)16-19-33(20-17-30)18-8-11-23-9-5-4-6-10-23/h4-6,9-10,13-14,21-22H,7-8,11-12,15-20H2,1-3H3,(H,34,35)