[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 2,3-dimethylquinoxaline-6-carboxylate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 2,3-dimethylquinoxaline-6-carboxylate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] 2,3-dimethylquinoxaline-6-carboxylate CAS Name: 2,3-dimethyl-6-quinoxalinecarboxylic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] 2,3-dimethylquinoxaline-6-carboxylate Traditional Name: 2,3-dimethylquinoxaline-6-carboxylic acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C19H16IN3O3 MolecularWeight: 461.25311

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)I)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)I)N=C1C

InChI

InChI=1S/C19H16IN3O3/c1-11-12(2)22-17-8-13(6-7-16(17)21-11)19(25)26-10-18(24)23-15-5-3-4-14(20)9-15/h3-9H,10H2,1-2H3,(H,23,24)