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

Systemtic Name: 5,5-dimethyl-2-[[(4-methylphenyl)amino]-(4-nitrophenyl)methylidene]cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-[(4-methylanilino)-(4-nitrophenyl)methylene]cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[(4-methylanilino)-(4-nitrophenyl)methylidene]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-[(4-methylanilino)-(4-nitrophenyl)methylidene]cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-[(4-nitrophenyl)-(p-toluidino)methylene]cyclohexane-1,3-quinone Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=C2C(=O)CC(CC2=O)(C)C)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=C2C(=O)CC(CC2=O)(C)C)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H22N2O4/c1-14-4-8-16(9-5-14)23-21(15-6-10-17(11-7-15)24(27)28)20-18(25)12-22(2,3)13-19(20)26/h4-11,23H,12-13H2,1-3H3