3-[[5-[4-(2,6-dimethylpiperidin-1-yl)pentyl]-3-oxidanylidene-4H-quinoxalin-2-yl]methyl]benzenecarboximidamide

Systemtic Name: 3-[[5-[4-(2,6-dimethylpiperidin-1-yl)pentyl]-3-oxidanylidene-4H-quinoxalin-2-yl]methyl]benzenecarboximidamide Openeye Name: 3-[[5-[4-(2,6-dimethyl-1-piperidyl)pentyl]-3-oxo-4H-quinoxalin-2-yl]methyl]benzamidine CAS Name: 3-[[5-[4-(2,6-dimethyl-1-piperidinyl)pentyl]-3-oxo-4H-quinoxalin-2-yl]methyl]benzenecarboximidamide IUPAC Name: 3-[[5-[4-(2,6-dimethylpiperidin-1-yl)pentyl]-3-oxo-4H-quinoxalin-2-yl]methyl]benzenecarboximidamide Traditional Name: 3-[[5-[4-(2,6-dimethylpiperidino)pentyl]-3-keto-4H-quinoxalin-2-yl]methyl]benzamidine Formula: C28H37N5O MolecularWeight: 459.62628

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(C)CCCC2=C3C(=CC=C2)N=C(C(=O)N3)CC4=CC=CC(=C4)C(=N)N)C

Isomeric SMILES

CC1CCCC(N1C(C)CCCC2=C3C(=CC=C2)N=C(C(=O)N3)CC4=CC=CC(=C4)C(=N)N)C

InChI

InChI=1S/C28H37N5O/c1-18-8-4-9-19(2)33(18)20(3)10-5-12-22-13-7-15-24-26(22)32-28(34)25(31-24)17-21-11-6-14-23(16-21)27(29)30/h6-7,11,13-16,18-20H,4-5,8-10,12,17H2,1-3H3,(H3,29,30)(H,32,34)