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

Systemtic Name: 3-[4-[5-(2,6-dimethylpiperidin-1-yl)pentyl]-1-methyl-3-oxidanylidene-2H-quinoxalin-2-yl]benzenecarbonitrile Openeye Name: 3-[4-[5-(2,6-dimethyl-1-piperidyl)pentyl]-1-methyl-3-oxo-2H-quinoxalin-2-yl]benzonitrile CAS Name: 3-[4-[5-(2,6-dimethyl-1-piperidinyl)pentyl]-1-methyl-3-oxo-2H-quinoxalin-2-yl]benzonitrile IUPAC Name: 3-[4-[5-(2,6-dimethylpiperidin-1-yl)pentyl]-1-methyl-3-oxo-2H-quinoxalin-2-yl]benzonitrile Traditional Name: 3-[4-[5-(2,6-dimethylpiperidino)pentyl]-3-keto-1-methyl-2H-quinoxalin-2-yl]benzonitrile Formula: C28H36N4O MolecularWeight: 444.61164

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CCCCCN2C3=CC=CC=C3N(C(C2=O)C4=CC=CC(=C4)C#N)C)C

Isomeric SMILES

CC1CCCC(N1CCCCCN2C3=CC=CC=C3N(C(C2=O)C4=CC=CC(=C4)C#N)C)C

InChI

InChI=1S/C28H36N4O/c1-21-11-9-12-22(2)31(21)17-7-4-8-18-32-26-16-6-5-15-25(26)30(3)27(28(32)33)24-14-10-13-23(19-24)20-29/h5-6,10,13-16,19,21-22,27H,4,7-9,11-12,17-18H2,1-3H3