methyl 4-[(2,6-dimethylphenyl)amino]-3,4-bis(oxidanylidene)-2-quinoxalin-2-yl-butanoate

Systemtic Name: methyl 4-[(2,6-dimethylphenyl)amino]-3,4-bis(oxidanylidene)-2-quinoxalin-2-yl-butanoate Openeye Name: methyl 4-(2,6-dimethylanilino)-3,4-dioxo-2-quinoxalin-2-yl-butanoate CAS Name: 4-(2,6-dimethylanilino)-3,4-dioxo-2-(2-quinoxalinyl)butanoic acid methyl ester IUPAC Name: methyl 4-(2,6-dimethylanilino)-3,4-dioxo-2-quinoxalin-2-ylbutanoate Traditional Name: 4-(2,6-dimethylanilino)-3,4-diketo-2-quinoxalin-2-yl-butyric acid methyl ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C(=O)C(C2=NC3=CC=CC=C3N=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C(=O)C(C2=NC3=CC=CC=C3N=C2)C(=O)OC

InChI

InChI=1S/C21H19N3O4/c1-12-7-6-8-13(2)18(12)24-20(26)19(25)17(21(27)28-3)16-11-22-14-9-4-5-10-15(14)23-16/h4-11,17H,1-3H3,(H,24,26)