2-[[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]cyclohexane-1,3-dione

Systemtic Name: 2-[[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]cyclohexane-1,3-dione Openeye Name: 2-[[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]cyclohexane-1,3-dione CAS Name: 2-[[1-(2,4-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]cyclohexane-1,3-dione IUPAC Name: 2-[[1-(2,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]cyclohexane-1,3-dione Traditional Name: 2-[[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]cyclohexane-1,3-quinone Formula: C21H23NO2 MolecularWeight: 321.41282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)CCCC3=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)CCCC3=O)C)C

InChI

InChI=1S/C21H23NO2/c1-13-8-9-19(14(2)10-13)22-15(3)11-17(16(22)4)12-18-20(23)6-5-7-21(18)24/h8-12H,5-7H2,1-4H3