3-[2-[(piperidin-4-ylmethylamino)methyl]-4-quinolin-2-yl-phenoxy]propan-1-amine

Systemtic Name: 3-[2-[(piperidin-4-ylmethylamino)methyl]-4-quinolin-2-yl-phenoxy]propan-1-amine Openeye Name: 3-[2-[(4-piperidylmethylamino)methyl]-4-(2-quinolyl)phenoxy]propan-1-amine CAS Name: 3-[2-[(4-piperidinylmethylamino)methyl]-4-(2-quinolinyl)phenoxy]-1-propanamine IUPAC Name: 3-[2-[(piperidin-4-ylmethylamino)methyl]-4-quinolin-2-ylphenoxy]propan-1-amine Traditional Name: [2-(3-aminopropoxy)-5-(2-quinolyl)benzyl]-(4-piperidylmethyl)amine Formula: C25H32N4O MolecularWeight: 404.54778

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CNCC2=C(C=CC(=C2)C3=NC4=CC=CC=C4C=C3)OCCCN

Isomeric SMILES

C1CNCCC1CNCC2=C(C=CC(=C2)C3=NC4=CC=CC=C4C=C3)OCCCN

InChI

InChI=1S/C25H32N4O/c26-12-3-15-30-25-9-7-21(24-8-6-20-4-1-2-5-23(20)29-24)16-22(25)18-28-17-19-10-13-27-14-11-19/h1-2,4-9,16,19,27-28H,3,10-15,17-18,26H2