3-[(E)-2-(2,4-dimethylphenyl)ethenyl]-1-ethyl-2-oxidanylidene-quinoxaline-6-carboxylic acid

Systemtic Name: 3-[(E)-2-(2,4-dimethylphenyl)ethenyl]-1-ethyl-2-oxidanylidene-quinoxaline-6-carboxylic acid Openeye Name: 3-[(E)-2-(2,4-dimethylphenyl)vinyl]-1-ethyl-2-oxo-quinoxaline-6-carboxylic acid CAS Name: 3-[(E)-2-(2,4-dimethylphenyl)ethenyl]-1-ethyl-2-oxo-6-quinoxalinecarboxylic acid IUPAC Name: 3-[(E)-2-(2,4-dimethylphenyl)ethenyl]-1-ethyl-2-oxoquinoxaline-6-carboxylic acid Traditional Name: 3-[(E)-2-(2,4-dimethylphenyl)vinyl]-1-ethyl-2-keto-quinoxaline-6-carboxylic acid Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)O)N=C(C1=O)C=CC3=C(C=C(C=C3)C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)O)N=C(C1=O)/C=C/C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C21H20N2O3/c1-4-23-19-10-8-16(21(25)26)12-18(19)22-17(20(23)24)9-7-15-6-5-13(2)11-14(15)3/h5-12H,4H2,1-3H3,(H,25,26)/b9-7+