3-[5-[1-[2-(hydroxymethyl)pyrrolidin-1-yl]pentyl]-2-oxidanylidene-1H-quinolin-3-yl]benzenecarboximidamide

Systemtic Name: 3-[5-[1-[2-(hydroxymethyl)pyrrolidin-1-yl]pentyl]-2-oxidanylidene-1H-quinolin-3-yl]benzenecarboximidamide Openeye Name: 3-[5-[1-[2-(hydroxymethyl)pyrrolidin-1-yl]pentyl]-2-oxo-1H-quinolin-3-yl]benzamidine CAS Name: 3-[5-[1-[2-(hydroxymethyl)-1-pyrrolidinyl]pentyl]-2-oxo-1H-quinolin-3-yl]benzenecarboximidamide IUPAC Name: 3-[5-[1-[2-(hydroxymethyl)pyrrolidin-1-yl]pentyl]-2-oxo-1H-quinolin-3-yl]benzenecarboximidamide Traditional Name: 3-[2-keto-5-[1-(2-methylolpyrrolidino)pentyl]-1H-quinolin-3-yl]benzamidine Formula: C26H32N4O2 MolecularWeight: 432.55788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=C2C=C(C(=O)NC2=CC=C1)C3=CC(=CC=C3)C(=N)N)N4CCCC4CO

Isomeric SMILES

CCCCC(C1=C2C=C(C(=O)NC2=CC=C1)C3=CC(=CC=C3)C(=N)N)N4CCCC4CO

InChI

InChI=1S/C26H32N4O2/c1-2-3-12-24(30-13-6-9-19(30)16-31)20-10-5-11-23-22(20)15-21(26(32)29-23)17-7-4-8-18(14-17)25(27)28/h4-5,7-8,10-11,14-15,19,24,31H,2-3,6,9,12-13,16H2,1H3,(H3,27,28)(H,29,32)