2-[[(2,4-dimethoxyphenyl)amino]methylidene]-5-phenyl-cyclohexane-1,3-dione

Systemtic Name: 2-[[(2,4-dimethoxyphenyl)amino]methylidene]-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2-[(2,4-dimethoxyanilino)methylene]-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-[(2,4-dimethoxyanilino)methylidene]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[(2,4-dimethoxyanilino)methylidene]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[(2,4-dimethoxyanilino)methylene]-5-phenyl-cyclohexane-1,3-quinone Formula: C21H21NO4 MolecularWeight: 351.39574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC=C2C(=O)CC(CC2=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC=C2C(=O)CC(CC2=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H21NO4/c1-25-16-8-9-18(21(12-16)26-2)22-13-17-19(23)10-15(11-20(17)24)14-6-4-3-5-7-14/h3-9,12-13,15,22H,10-11H2,1-2H3