heptyl 2-cyano-2-[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]ethanoate

Systemtic Name: heptyl 2-cyano-2-[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]ethanoate Openeye Name: heptyl 2-cyano-2-[3-(3-methyl-1-piperidyl)quinoxalin-2-yl]acetate CAS Name: 2-cyano-2-[3-(3-methyl-1-piperidinyl)-2-quinoxalinyl]acetic acid heptyl ester IUPAC Name: heptyl 2-cyano-2-[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate Traditional Name: 2-cyano-2-[3-(3-methylpiperidino)quinoxalin-2-yl]acetic acid heptyl ester Formula: C24H32N4O2 MolecularWeight: 408.53648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCCC(C3)C

Isomeric SMILES

CCCCCCCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCCC(C3)C

InChI

InChI=1S/C24H32N4O2/c1-3-4-5-6-9-15-30-24(29)19(16-25)22-23(28-14-10-11-18(2)17-28)27-21-13-8-7-12-20(21)26-22/h7-8,12-13,18-19H,3-6,9-11,14-15,17H2,1-2H3