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methyl 2-cyano-2-[3-[1-(4-ethylphenyl)ethylamino]quinoxalin-2-yl]ethanoate
methyl 2-cyano-2-[3-[1-(4-ethylphenyl)ethylamino]quinoxalin-2-yl]ethanoate
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Descriptors Computed from Structure
Canonical SMILES:
CCC1=CC=C(C=C1)C(C)NC2=NC3=CC=CC=C3N=C2C(C#N)C(=O)OC
Isomeric SMILES
CCC1=CC=C(C=C1)C(C)NC2=NC3=CC=CC=C3N=C2C(C#N)C(=O)OC
InChI
InChI=1S/C22H22N4O2/c1-4-15-9-11-16(12-10-15)14(2)24-21-20(17(13-23)22(27)28-3)25-18-7-5-6-8-19(18)26-21/h5-12,14,17H,4H2,1-3H3,(H,24,26)
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