ethyl 2-cyano-2-[3-[2-hydroxyethyl-(phenylmethyl)amino]quinoxalin-2-yl]ethanoate

Systemtic Name: ethyl 2-cyano-2-[3-[2-hydroxyethyl-(phenylmethyl)amino]quinoxalin-2-yl]ethanoate Openeye Name: ethyl 2-[3-[benzyl(2-hydroxyethyl)amino]quinoxalin-2-yl]-2-cyano-acetate CAS Name: 2-cyano-2-[3-[2-hydroxyethyl-(phenylmethyl)amino]-2-quinoxalinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[benzyl(2-hydroxyethyl)amino]quinoxalin-2-yl]-2-cyanoacetate Traditional Name: 2-[3-[benzyl(2-hydroxyethyl)amino]quinoxalin-2-yl]-2-cyano-acetic acid ethyl ester Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N(CCO)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N(CCO)CC3=CC=CC=C3

InChI

InChI=1S/C22H22N4O3/c1-2-29-22(28)17(14-23)20-21(25-19-11-7-6-10-18(19)24-20)26(12-13-27)15-16-8-4-3-5-9-16/h3-11,17,27H,2,12-13,15H2,1H3