1-[1-(3,5-dimethylphenyl)-5-methyl-3-(4-nitrophenyl)pyrrol-2-yl]propan-2-one

Systemtic Name: 1-[1-(3,5-dimethylphenyl)-5-methyl-3-(4-nitrophenyl)pyrrol-2-yl]propan-2-one Openeye Name: 1-[1-(3,5-dimethylphenyl)-5-methyl-3-(4-nitrophenyl)pyrrol-2-yl]propan-2-one CAS Name: 1-[1-(3,5-dimethylphenyl)-5-methyl-3-(4-nitrophenyl)-2-pyrrolyl]-2-propanone IUPAC Name: 1-[1-(3,5-dimethylphenyl)-5-methyl-3-(4-nitrophenyl)pyrrol-2-yl]propan-2-one Traditional Name: 1-[1-(3,5-dimethylphenyl)-5-methyl-3-(4-nitrophenyl)pyrrol-2-yl]acetone Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=CC(=C2CC(=O)C)C3=CC=C(C=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=CC(=C2CC(=O)C)C3=CC=C(C=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C22H22N2O3/c1-14-9-15(2)11-20(10-14)23-16(3)12-21(22(23)13-17(4)25)18-5-7-19(8-6-18)24(26)27/h5-12H,13H2,1-4H3