cyclohexyl (2S)-2-cyano-2-[3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]quinoxalin-2-yl]ethanoate

Systemtic Name: cyclohexyl (2S)-2-cyano-2-[3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]quinoxalin-2-yl]ethanoate Openeye Name: cyclohexyl (2S)-2-cyano-2-[3-[(3R,5R)-3,5-dimethyl-1-piperidyl]quinoxalin-2-yl]acetate CAS Name: (2S)-2-cyano-2-[3-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-2-quinoxalinyl]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl (2S)-2-cyano-2-[3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]quinoxalin-2-yl]acetate Traditional Name: (2S)-2-cyano-2-[3-[(3R,5R)-3,5-dimethylpiperidino]quinoxalin-2-yl]acetic acid cyclohexyl ester Formula: C24H30N4O2 MolecularWeight: 406.5206

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)OC4CCCCC4)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)C2=NC3=CC=CC=C3N=C2[C@@H](C#N)C(=O)OC4CCCCC4)C

InChI

InChI=1S/C24H30N4O2/c1-16-12-17(2)15-28(14-16)23-22(26-20-10-6-7-11-21(20)27-23)19(13-25)24(29)30-18-8-4-3-5-9-18/h6-7,10-11,16-19H,3-5,8-9,12,14-15H2,1-2H3/t16-,17-,19-/m1/s1