2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)piperidin-1-yl]-1-(6-methoxyquinolin-4-yl)ethanol

Systemtic Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)piperidin-1-yl]-1-(6-methoxyquinolin-4-yl)ethanol Openeye Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-1-piperidyl]-1-(6-methoxy-4-quinolyl)ethanol CAS Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-1-piperidinyl]-1-(6-methoxy-4-quinolinyl)ethanol IUPAC Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)piperidin-1-yl]-1-(6-methoxyquinolin-4-yl)ethanol Traditional Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)piperidino]-1-(6-methoxy-4-quinolyl)ethanol Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)C(CN3CCC(CC3)NCC4=CC5=C(C=C4)OCCO5)O

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)C(CN3CCC(CC3)NCC4=CC5=C(C=C4)OCCO5)O

InChI

InChI=1S/C26H31N3O4/c1-31-20-3-4-23-22(15-20)21(6-9-27-23)24(30)17-29-10-7-19(8-11-29)28-16-18-2-5-25-26(14-18)33-13-12-32-25/h2-6,9,14-15,19,24,28,30H,7-8,10-13,16-17H2,1H3