1-[5-[(2S,6R)-2,6-dimethylpiperidin-1-yl]pentyl]-3-(1H-pyrazol-5-yl)quinoxalin-2-one

Systemtic Name: 1-[5-[(2S,6R)-2,6-dimethylpiperidin-1-yl]pentyl]-3-(1H-pyrazol-5-yl)quinoxalin-2-one Openeye Name: 1-[5-[(2S,6R)-2,6-dimethyl-1-piperidyl]pentyl]-3-(1H-pyrazol-5-yl)quinoxalin-2-one CAS Name: 1-[5-[(2S,6R)-2,6-dimethyl-1-piperidinyl]pentyl]-3-(1H-pyrazol-5-yl)-2-quinoxalinone IUPAC Name: 1-[5-[(2S,6R)-2,6-dimethylpiperidin-1-yl]pentyl]-3-(1H-pyrazol-5-yl)quinoxalin-2-one Traditional Name: 1-[5-[(2S,6R)-2,6-dimethylpiperidino]pentyl]-3-(1H-pyrazol-5-yl)quinoxalin-2-one Formula: C23H31N5O MolecularWeight: 393.52514

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CCCCCN2C3=CC=CC=C3N=C(C2=O)C4=CC=NN4)C

Isomeric SMILES

C[C@@H]1CCC[C@@H](N1CCCCCN2C3=CC=CC=C3N=C(C2=O)C4=CC=NN4)C

InChI

InChI=1S/C23H31N5O/c1-17-9-8-10-18(2)27(17)15-6-3-7-16-28-21-12-5-4-11-19(21)25-22(23(28)29)20-13-14-24-26-20/h4-5,11-14,17-18H,3,6-10,15-16H2,1-2H3,(H,24,26)/t17-,18+