3-[5-[1-(2,6-dimethylpiperidin-1-yl)pentyl]-7-(hydroxymethyl)-2-oxidanylidene-1H-quinolin-3-yl]benzenecarboximidamide

Systemtic Name: 3-[5-[1-(2,6-dimethylpiperidin-1-yl)pentyl]-7-(hydroxymethyl)-2-oxidanylidene-1H-quinolin-3-yl]benzenecarboximidamide Openeye Name: 3-[5-[1-(2,6-dimethyl-1-piperidyl)pentyl]-7-(hydroxymethyl)-2-oxo-1H-quinolin-3-yl]benzamidine CAS Name: 3-[5-[1-(2,6-dimethyl-1-piperidinyl)pentyl]-7-(hydroxymethyl)-2-oxo-1H-quinolin-3-yl]benzenecarboximidamide IUPAC Name: 3-[5-[1-(2,6-dimethylpiperidin-1-yl)pentyl]-7-(hydroxymethyl)-2-oxo-1H-quinolin-3-yl]benzenecarboximidamide Traditional Name: 3-[5-[1-(2,6-dimethylpiperidino)pentyl]-2-keto-7-methylol-1H-quinolin-3-yl]benzamidine Formula: C29H38N4O2 MolecularWeight: 474.63762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=C2C=C(C(=O)NC2=CC(=C1)CO)C3=CC(=CC=C3)C(=N)N)N4C(CCCC4C)C

Isomeric SMILES

CCCCC(C1=C2C=C(C(=O)NC2=CC(=C1)CO)C3=CC(=CC=C3)C(=N)N)N4C(CCCC4C)C

InChI

InChI=1S/C29H38N4O2/c1-4-5-12-27(33-18(2)8-6-9-19(33)3)25-13-20(17-34)14-26-24(25)16-23(29(35)32-26)21-10-7-11-22(15-21)28(30)31/h7,10-11,13-16,18-19,27,34H,4-6,8-9,12,17H2,1-3H3,(H3,30,31)(H,32,35)