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

Systemtic Name: methyl 2-cyano-2-[3-[(4-oxidanylcyclohexyl)amino]quinoxalin-2-yl]ethanoate Openeye Name: methyl 2-cyano-2-[3-[(4-hydroxycyclohexyl)amino]quinoxalin-2-yl]acetate CAS Name: 2-cyano-2-[3-[(4-hydroxycyclohexyl)amino]-2-quinoxalinyl]acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-[3-[(4-hydroxycyclohexyl)amino]quinoxalin-2-yl]acetate Traditional Name: 2-cyano-2-[3-[(4-hydroxycyclohexyl)amino]quinoxalin-2-yl]acetic acid methyl ester Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1NC3CCC(CC3)O

Isomeric SMILES

COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1NC3CCC(CC3)O

InChI

InChI=1S/C18H20N4O3/c1-25-18(24)13(10-19)16-17(20-11-6-8-12(23)9-7-11)22-15-5-3-2-4-14(15)21-16/h2-5,11-13,23H,6-9H2,1H3,(H,20,22)