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

Systemtic Name: 5,5-dimethyl-2-[[1-(3-nitrophenyl)pyrrol-2-yl]methylidene]cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-[[1-(3-nitrophenyl)pyrrol-2-yl]methylene]cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[[1-(3-nitrophenyl)-2-pyrrolyl]methylidene]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-[[1-(3-nitrophenyl)pyrrol-2-yl]methylidene]cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-[[1-(3-nitrophenyl)pyrrol-2-yl]methylene]cyclohexane-1,3-quinone Formula: C19H18N2O4 MolecularWeight: 338.35722

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=CC2=CC=CN2C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=CC2=CC=CN2C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C1)C

InChI

InChI=1S/C19H18N2O4/c1-19(2)11-17(22)16(18(23)12-19)10-14-7-4-8-20(14)13-5-3-6-15(9-13)21(24)25/h3-10H,11-12H2,1-2H3