3-[(E)-2-(4-butoxyphenyl)ethenyl]-1-ethyl-2-oxidanylidene-quinoxaline-6-carboxylate

Systemtic Name: 3-[(E)-2-(4-butoxyphenyl)ethenyl]-1-ethyl-2-oxidanylidene-quinoxaline-6-carboxylate Openeye Name: 3-[(E)-2-(4-butoxyphenyl)vinyl]-1-ethyl-2-oxo-quinoxaline-6-carboxylate CAS Name: 3-[(E)-2-(4-butoxyphenyl)ethenyl]-1-ethyl-2-oxo-6-quinoxalinecarboxylate IUPAC Name: 3-[(E)-2-(4-butoxyphenyl)ethenyl]-1-ethyl-2-oxoquinoxaline-6-carboxylate Traditional Name: 3-[(E)-2-(4-butoxyphenyl)vinyl]-1-ethyl-2-keto-quinoxaline-6-carboxylate Formula: C23H23N2O4- MolecularWeight: 391.43972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=CC2=NC3=C(C=CC(=C3)C(=O)[O-])N(C2=O)CC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C/C2=NC3=C(C=CC(=C3)C(=O)[O-])N(C2=O)CC

InChI

InChI=1S/C23H24N2O4/c1-3-5-14-29-18-10-6-16(7-11-18)8-12-19-22(26)25(4-2)21-13-9-17(23(27)28)15-20(21)24-19/h6-13,15H,3-5,14H2,1-2H3,(H,27,28)/p-1/b12-8+