3-[5-[1-[2-(hydroxymethyl)-5-methyl-pyrrolidin-1-yl]pentyl]-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]benzenecarboximidamide

Systemtic Name: 3-[5-[1-[2-(hydroxymethyl)-5-methyl-pyrrolidin-1-yl]pentyl]-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]benzenecarboximidamide Openeye Name: 3-[5-[1-[2-(hydroxymethyl)-5-methyl-pyrrolidin-1-yl]pentyl]-2-oxo-3,4-dihydro-1H-quinolin-3-yl]benzamidine CAS Name: 3-[5-[1-[2-(hydroxymethyl)-5-methyl-1-pyrrolidinyl]pentyl]-2-oxo-3,4-dihydro-1H-quinolin-3-yl]benzenecarboximidamide IUPAC Name: 3-[5-[1-[2-(hydroxymethyl)-5-methylpyrrolidin-1-yl]pentyl]-2-oxo-3,4-dihydro-1H-quinolin-3-yl]benzenecarboximidamide Traditional Name: 3-[2-keto-5-[1-(2-methyl-5-methylol-pyrrolidino)pentyl]-3,4-dihydro-1H-quinolin-3-yl]benzamidine Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=C2CC(C(=O)NC2=CC=C1)C3=CC=CC(=C3)C(=N)N)N4C(CCC4CO)C

Isomeric SMILES

CCCCC(C1=C2CC(C(=O)NC2=CC=C1)C3=CC=CC(=C3)C(=N)N)N4C(CCC4CO)C

InChI

InChI=1S/C27H36N4O2/c1-3-4-11-25(31-17(2)12-13-20(31)16-32)21-9-6-10-24-23(21)15-22(27(33)30-24)18-7-5-8-19(14-18)26(28)29/h5-10,14,17,20,22,25,32H,3-4,11-13,15-16H2,1-2H3,(H3,28,29)(H,30,33)