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

Systemtic Name: 5-(3-methoxyphenyl)-2-[[(4-methylphenyl)amino]methylidene]cyclohexane-1,3-dione Openeye Name: 5-(3-methoxyphenyl)-2-[(4-methylanilino)methylene]cyclohexane-1,3-dione CAS Name: 5-(3-methoxyphenyl)-2-[(4-methylanilino)methylidene]cyclohexane-1,3-dione IUPAC Name: 5-(3-methoxyphenyl)-2-[(4-methylanilino)methylidene]cyclohexane-1,3-dione Traditional Name: 5-(3-methoxyphenyl)-2-(p-toluidinomethylene)cyclohexane-1,3-quinone Formula: C21H21NO3 MolecularWeight: 335.39634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC=C2C(=O)CC(CC2=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC=C2C(=O)CC(CC2=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C21H21NO3/c1-14-6-8-17(9-7-14)22-13-19-20(23)11-16(12-21(19)24)15-4-3-5-18(10-15)25-2/h3-10,13,16,22H,11-12H2,1-2H3