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

Systemtic Name: propan-2-yl (2R)-2-cyano-2-[3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]quinoxalin-2-yl]ethanoate Openeye Name: isopropyl (2R)-2-cyano-2-[3-[(3R,5R)-3,5-dimethyl-1-piperidyl]quinoxalin-2-yl]acetate CAS Name: (2R)-2-cyano-2-[3-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-2-quinoxalinyl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl (2R)-2-cyano-2-[3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]quinoxalin-2-yl]acetate Traditional Name: (2R)-2-cyano-2-[3-[(3R,5R)-3,5-dimethylpiperidino]quinoxalin-2-yl]acetic acid isopropyl ester Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O2/c1-13(2)27-21(26)16(10-22)19-20(25-11-14(3)9-15(4)12-25)24-18-8-6-5-7-17(18)23-19/h5-8,13-16H,9,11-12H2,1-4H3/t14-,15-,16+/m1/s1