3-[(4-bromanyl-3-methyl-phenyl)amino]-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[(4-bromanyl-3-methyl-phenyl)amino]-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione Openeye Name: 3-(4-bromo-3-methyl-anilino)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione CAS Name: 3-(4-bromo-3-methylanilino)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(4-bromo-3-methylanilino)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione Traditional Name: 3-(4-bromo-3-methyl-anilino)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-quinone Formula: C20H18BrNO2 MolecularWeight: 384.26642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=C(C(=O)C2=O)NC3=CC(=C(C=C3)Br)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=C(C(=O)C2=O)NC3=CC(=C(C=C3)Br)C)C)C

InChI

InChI=1S/C20H18BrNO2/c1-10-7-12(3)15(9-11(10)2)17-18(20(24)19(17)23)22-14-5-6-16(21)13(4)8-14/h5-9,22H,1-4H3