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

Systemtic Name: 5-(3,4-dimethoxyphenyl)-2-[[(2-methylphenyl)amino]methylidene]cyclohexane-1,3-dione Openeye Name: 5-(3,4-dimethoxyphenyl)-2-[(2-methylanilino)methylene]cyclohexane-1,3-dione CAS Name: 5-(3,4-dimethoxyphenyl)-2-[(2-methylanilino)methylidene]cyclohexane-1,3-dione IUPAC Name: 5-(3,4-dimethoxyphenyl)-2-[(2-methylanilino)methylidene]cyclohexane-1,3-dione Traditional Name: 5-(3,4-dimethoxyphenyl)-2-(o-toluidinomethylene)cyclohexane-1,3-quinone Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC=C2C(=O)CC(CC2=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=CC=C1NC=C2C(=O)CC(CC2=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H23NO4/c1-14-6-4-5-7-18(14)23-13-17-19(24)10-16(11-20(17)25)15-8-9-21(26-2)22(12-15)27-3/h4-9,12-13,16,23H,10-11H2,1-3H3