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

Systemtic Name: 1-ethyl-2-oxidanylidene-3-[(E)-2-(4-propan-2-ylphenyl)ethenyl]quinoxaline-6-carboxylic acid Openeye Name: 1-ethyl-3-[(E)-2-(4-isopropylphenyl)vinyl]-2-oxo-quinoxaline-6-carboxylic acid CAS Name: 1-ethyl-2-oxo-3-[(E)-2-(4-propan-2-ylphenyl)ethenyl]-6-quinoxalinecarboxylic acid IUPAC Name: 1-ethyl-2-oxo-3-[(E)-2-(4-propan-2-ylphenyl)ethenyl]quinoxaline-6-carboxylic acid Traditional Name: 1-ethyl-2-keto-3-[(E)-2-p-cumenylvinyl]quinoxaline-6-carboxylic acid Formula: C22H22N2O3 MolecularWeight: 362.42168

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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=CC=C(C=C3)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O3/c1-4-24-20-12-10-17(22(26)27)13-19(20)23-18(21(24)25)11-7-15-5-8-16(9-6-15)14(2)3/h5-14H,4H2,1-3H3,(H,26,27)/b11-7+