methyl 2-cyano-2-[3-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxalin-2-yl]ethanoate

Systemtic Name: methyl 2-cyano-2-[3-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxalin-2-yl]ethanoate Openeye Name: methyl 2-cyano-2-[3-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxalin-2-yl]acetate CAS Name: 2-cyano-2-[3-[4-(3-methoxyphenyl)-1-piperazinyl]-2-quinoxalinyl]acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-[3-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxalin-2-yl]acetate Traditional Name: 2-cyano-2-[3-[4-(3-methoxyphenyl)piperazino]quinoxalin-2-yl]acetic acid methyl ester Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C3=NC4=CC=CC=C4N=C3C(C#N)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C3=NC4=CC=CC=C4N=C3C(C#N)C(=O)OC

InChI

InChI=1S/C23H23N5O3/c1-30-17-7-5-6-16(14-17)27-10-12-28(13-11-27)22-21(18(15-24)23(29)31-2)25-19-8-3-4-9-20(19)26-22/h3-9,14,18H,10-13H2,1-2H3