3-[(E)-2-(4-butoxy-3-methoxy-phenyl)ethenyl]-1-ethyl-2-oxidanylidene-quinoxaline-6-carboxylic acid

Systemtic Name: 3-[(E)-2-(4-butoxy-3-methoxy-phenyl)ethenyl]-1-ethyl-2-oxidanylidene-quinoxaline-6-carboxylic acid Openeye Name: 3-[(E)-2-(4-butoxy-3-methoxy-phenyl)vinyl]-1-ethyl-2-oxo-quinoxaline-6-carboxylic acid CAS Name: 3-[(E)-2-(4-butoxy-3-methoxyphenyl)ethenyl]-1-ethyl-2-oxo-6-quinoxalinecarboxylic acid IUPAC Name: 3-[(E)-2-(4-butoxy-3-methoxyphenyl)ethenyl]-1-ethyl-2-oxoquinoxaline-6-carboxylic acid Traditional Name: 3-[(E)-2-(4-butoxy-3-methoxy-phenyl)vinyl]-1-ethyl-2-keto-quinoxaline-6-carboxylic acid Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=CC2=NC3=C(C=CC(=C3)C(=O)O)N(C2=O)CC)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C/C2=NC3=C(C=CC(=C3)C(=O)O)N(C2=O)CC)OC

InChI

InChI=1S/C24H26N2O5/c1-4-6-13-31-21-12-8-16(14-22(21)30-3)7-10-18-23(27)26(5-2)20-11-9-17(24(28)29)15-19(20)25-18/h7-12,14-15H,4-6,13H2,1-3H3,(H,28,29)/b10-7+