3-[(E)-2-(3-ethoxy-4-prop-2-ynoxy-phenyl)ethenyl]-1-ethyl-2-oxidanylidene-quinoxaline-6-carboxylic acid

Systemtic Name: 3-[(E)-2-(3-ethoxy-4-prop-2-ynoxy-phenyl)ethenyl]-1-ethyl-2-oxidanylidene-quinoxaline-6-carboxylic acid Openeye Name: 3-[(E)-2-(3-ethoxy-4-prop-2-ynoxy-phenyl)vinyl]-1-ethyl-2-oxo-quinoxaline-6-carboxylic acid CAS Name: 3-[(E)-2-(3-ethoxy-4-prop-2-ynoxyphenyl)ethenyl]-1-ethyl-2-oxo-6-quinoxalinecarboxylic acid IUPAC Name: 3-[(E)-2-(3-ethoxy-4-prop-2-ynoxyphenyl)ethenyl]-1-ethyl-2-oxoquinoxaline-6-carboxylic acid Traditional Name: 3-[(E)-2-(3-ethoxy-4-propargyloxy-phenyl)vinyl]-1-ethyl-2-keto-quinoxaline-6-carboxylic acid Formula: C24H22N2O5 MolecularWeight: 418.44188

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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)OCC#C)OCC

Isomeric SMILES

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

InChI

InChI=1S/C24H22N2O5/c1-4-13-31-21-12-8-16(14-22(21)30-6-3)7-10-18-23(27)26(5-2)20-11-9-17(24(28)29)15-19(20)25-18/h1,7-12,14-15H,5-6,13H2,2-3H3,(H,28,29)/b10-7+