6-[2-(aminomethyl)-3-(hydroxymethyl)-6-(6-quinolin-2-ylhexyl)phenyl]hexanal

Systemtic Name: 6-[2-(aminomethyl)-3-(hydroxymethyl)-6-(6-quinolin-2-ylhexyl)phenyl]hexanal Openeye Name: 6-[2-(aminomethyl)-3-(hydroxymethyl)-6-[6-(2-quinolyl)hexyl]phenyl]hexanal CAS Name: 6-[2-(aminomethyl)-3-(hydroxymethyl)-6-[6-(2-quinolinyl)hexyl]phenyl]hexanal IUPAC Name: 6-[2-(aminomethyl)-3-(hydroxymethyl)-6-(6-quinolin-2-ylhexyl)phenyl]hexanal Traditional Name: 6-[2-(aminomethyl)-3-methylol-6-[6-(2-quinolyl)hexyl]phenyl]hexanal Formula: C29H38N2O2 MolecularWeight: 446.62422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)CCCCCCC3=C(C(=C(C=C3)CO)CN)CCCCCC=O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)CCCCCCC3=C(C(=C(C=C3)CO)CN)CCCCCC=O

InChI

InChI=1S/C29H38N2O2/c30-21-28-25(22-33)17-16-23(27(28)14-7-3-4-10-20-32)11-5-1-2-6-13-26-19-18-24-12-8-9-15-29(24)31-26/h8-9,12,15-20,33H,1-7,10-11,13-14,21-22,30H2