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

Systemtic Name: 3-(5-bromanyl-2,4-dimethoxy-phenyl)-4-[(2-methyl-1-phenyl-propan-2-yl)amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-(5-bromo-2,4-dimethoxy-phenyl)-4-[(1,1-dimethyl-2-phenyl-ethyl)amino]cyclobut-3-ene-1,2-dione CAS Name: 3-(5-bromo-2,4-dimethoxyphenyl)-4-[(2-methyl-1-phenylpropan-2-yl)amino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-(5-bromo-2,4-dimethoxyphenyl)-4-[(2-methyl-1-phenylpropan-2-yl)amino]cyclobut-3-ene-1,2-dione Traditional Name: 3-(5-bromo-2,4-dimethoxy-phenyl)-4-[(1,1-dimethyl-2-phenyl-ethyl)amino]cyclobut-3-ene-1,2-quinone Formula: C22H22BrNO4 MolecularWeight: 444.31838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=CC=C1)NC2=C(C(=O)C2=O)C3=CC(=C(C=C3OC)OC)Br

Isomeric SMILES

CC(C)(CC1=CC=CC=C1)NC2=C(C(=O)C2=O)C3=CC(=C(C=C3OC)OC)Br

InChI

InChI=1S/C22H22BrNO4/c1-22(2,12-13-8-6-5-7-9-13)24-19-18(20(25)21(19)26)14-10-15(23)17(28-4)11-16(14)27-3/h5-11,24H,12H2,1-4H3