1-[3-(2,6-dimethoxyphenoxy)propyl]-4-quinolin-3-yl-piperidin-4-ol; ethanedioic acid

Systemtic Name: 1-[3-(2,6-dimethoxyphenoxy)propyl]-4-quinolin-3-yl-piperidin-4-ol; ethanedioic acid Openeye Name: 1-[3-(2,6-dimethoxyphenoxy)propyl]-4-(3-quinolyl)piperidin-4-ol; oxalic acid CAS Name: 1-[3-(2,6-dimethoxyphenoxy)propyl]-4-(3-quinolinyl)-4-piperidinol; oxalic acid IUPAC Name: 1-[3-(2,6-dimethoxyphenoxy)propyl]-4-quinolin-3-ylpiperidin-4-ol; oxalic acid Traditional Name: 1-[3-(2,6-dimethoxyphenoxy)propyl]-4-(3-quinolyl)piperidin-4-ol; oxalic acid Formula: C27H32N2O8 MolecularWeight: 512.55158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)OCCCN2CCC(CC2)(C3=CC4=CC=CC=C4N=C3)O.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C(=CC=C1)OC)OCCCN2CCC(CC2)(C3=CC4=CC=CC=C4N=C3)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H30N2O4.C2H2O4/c1-29-22-9-5-10-23(30-2)24(22)31-16-6-13-27-14-11-25(28,12-15-27)20-17-19-7-3-4-8-21(19)26-18-20;3-1(4)2(5)6/h3-5,7-10,17-18,28H,6,11-16H2,1-2H3;(H,3,4)(H,5,6)