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

Systemtic Name: 3-[4-[[4-(2,6-dimethylpiperidin-1-yl)phenyl]methyl]-3-oxidanylidene-quinoxalin-2-yl]benzenecarboximidamide Openeye Name: 3-[4-[[4-(2,6-dimethyl-1-piperidyl)phenyl]methyl]-3-oxo-quinoxalin-2-yl]benzamidine CAS Name: 3-[4-[[4-(2,6-dimethyl-1-piperidinyl)phenyl]methyl]-3-oxo-2-quinoxalinyl]benzenecarboximidamide IUPAC Name: 3-[4-[[4-(2,6-dimethylpiperidin-1-yl)phenyl]methyl]-3-oxoquinoxalin-2-yl]benzenecarboximidamide Traditional Name: 3-[4-[4-(2,6-dimethylpiperidino)benzyl]-3-keto-quinoxalin-2-yl]benzamidine Formula: C29H31N5O MolecularWeight: 465.58934

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C2=CC=C(C=C2)CN3C4=CC=CC=C4N=C(C3=O)C5=CC(=CC=C5)C(=N)N)C

Isomeric SMILES

CC1CCCC(N1C2=CC=C(C=C2)CN3C4=CC=CC=C4N=C(C3=O)C5=CC(=CC=C5)C(=N)N)C

InChI

InChI=1S/C29H31N5O/c1-19-7-5-8-20(2)34(19)24-15-13-21(14-16-24)18-33-26-12-4-3-11-25(26)32-27(29(33)35)22-9-6-10-23(17-22)28(30)31/h3-4,6,9-17,19-20H,5,7-8,18H2,1-2H3,(H3,30,31)