3-[(2,5-dimethylphenyl)amino]-4-(3-oxidanylidene-4H-1,4-benzoxazin-7-yl)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[(2,5-dimethylphenyl)amino]-4-(3-oxidanylidene-4H-1,4-benzoxazin-7-yl)cyclobut-3-ene-1,2-dione Openeye Name: 3-(2,5-dimethylanilino)-4-(3-oxo-4H-1,4-benzoxazin-7-yl)cyclobut-3-ene-1,2-dione CAS Name: 3-(2,5-dimethylanilino)-4-(3-oxo-4H-1,4-benzoxazin-7-yl)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(2,5-dimethylanilino)-4-(3-oxo-4H-1,4-benzoxazin-7-yl)cyclobut-3-ene-1,2-dione Traditional Name: 3-(2,5-dimethylanilino)-4-(3-keto-4H-1,4-benzoxazin-7-yl)cyclobut-3-ene-1,2-quinone Formula: C20H16N2O4 MolecularWeight: 348.35204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC2=C(C(=O)C2=O)C3=CC4=C(C=C3)NC(=O)CO4

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC2=C(C(=O)C2=O)C3=CC4=C(C=C3)NC(=O)CO4

InChI

InChI=1S/C20H16N2O4/c1-10-3-4-11(2)14(7-10)22-18-17(19(24)20(18)25)12-5-6-13-15(8-12)26-9-16(23)21-13/h3-8,22H,9H2,1-2H3,(H,21,23)