diethyl 2-[(3E)-3-phenacylidene-1,4-dihydroquinoxalin-2-ylidene]propanedioate

Systemtic Name: diethyl 2-[(3E)-3-phenacylidene-1,4-dihydroquinoxalin-2-ylidene]propanedioate Openeye Name: diethyl 2-[(3E)-3-phenacylidene-1,4-dihydroquinoxalin-2-ylidene]propanedioate CAS Name: 2-[(3E)-3-phenacylidene-1,4-dihydroquinoxalin-2-ylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(3E)-3-phenacylidene-1,4-dihydroquinoxalin-2-ylidene]propanedioate Traditional Name: 2-[(3E)-3-phenacylidene-1,4-dihydroquinoxalin-2-ylidene]malonic acid diethyl ester Formula: C23H22N2O5 MolecularWeight: 406.43118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1C(=CC(=O)C2=CC=CC=C2)NC3=CC=CC=C3N1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=C1/C(=C\C(=O)C2=CC=CC=C2)/NC3=CC=CC=C3N1)C(=O)OCC

InChI

InChI=1S/C23H22N2O5/c1-3-29-22(27)20(23(28)30-4-2)21-18(14-19(26)15-10-6-5-7-11-15)24-16-12-8-9-13-17(16)25-21/h5-14,24-25H,3-4H2,1-2H3/b18-14+