[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] 2,3-dimethylquinoxaline-6-carboxylate

Systemtic Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] 2,3-dimethylquinoxaline-6-carboxylate Openeye Name: [2-(1,1-diethylprop-2-ynylamino)-2-oxo-ethyl] 2,3-dimethylquinoxaline-6-carboxylate CAS Name: 2,3-dimethyl-6-quinoxalinecarboxylic acid [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] 2,3-dimethylquinoxaline-6-carboxylate Traditional Name: 2,3-dimethylquinoxaline-6-carboxylic acid [2-(1,1-diethylprop-2-ynylamino)-2-keto-ethyl] ester Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)COC(=O)C1=CC2=C(C=C1)N=C(C(=N2)C)C

Isomeric SMILES

CCC(CC)(C#C)NC(=O)COC(=O)C1=CC2=C(C=C1)N=C(C(=N2)C)C

InChI

InChI=1S/C20H23N3O3/c1-6-20(7-2,8-3)23-18(24)12-26-19(25)15-9-10-16-17(11-15)22-14(5)13(4)21-16/h1,9-11H,7-8,12H2,2-5H3,(H,23,24)