methyl 2-cyano-2-[3-[(3,4-dimethoxyphenyl)methyl-methyl-amino]quinoxalin-2-yl]ethanoate

Systemtic Name: methyl 2-cyano-2-[3-[(3,4-dimethoxyphenyl)methyl-methyl-amino]quinoxalin-2-yl]ethanoate Openeye Name: methyl 2-cyano-2-[3-[(3,4-dimethoxyphenyl)methyl-methyl-amino]quinoxalin-2-yl]acetate CAS Name: 2-cyano-2-[3-[(3,4-dimethoxyphenyl)methyl-methylamino]-2-quinoxalinyl]acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-[3-[(3,4-dimethoxyphenyl)methyl-methylamino]quinoxalin-2-yl]acetate Traditional Name: 2-cyano-2-[3-[methyl(veratryl)amino]quinoxalin-2-yl]acetic acid methyl ester Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)OC)C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)OC

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)OC)C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)OC

InChI

InChI=1S/C22H22N4O4/c1-26(13-14-9-10-18(28-2)19(11-14)29-3)21-20(15(12-23)22(27)30-4)24-16-7-5-6-8-17(16)25-21/h5-11,15H,13H2,1-4H3