3-(3,4-dimethylphenyl)-4-[(2-ethyl-6-methyl-phenyl)amino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(3,4-dimethylphenyl)-4-[(2-ethyl-6-methyl-phenyl)amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-(3,4-dimethylphenyl)-4-(2-ethyl-6-methyl-anilino)cyclobut-3-ene-1,2-dione CAS Name: 3-(3,4-dimethylphenyl)-4-(2-ethyl-6-methylanilino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(3,4-dimethylphenyl)-4-(2-ethyl-6-methylanilino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(3,4-dimethylphenyl)-4-(2-ethyl-6-methyl-anilino)cyclobut-3-ene-1,2-quinone Formula: C21H21NO2 MolecularWeight: 319.39694

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC2=C(C(=O)C2=O)C3=CC(=C(C=C3)C)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC2=C(C(=O)C2=O)C3=CC(=C(C=C3)C)C)C

InChI

InChI=1S/C21H21NO2/c1-5-15-8-6-7-13(3)18(15)22-19-17(20(23)21(19)24)16-10-9-12(2)14(4)11-16/h6-11,22H,5H2,1-4H3