6-(3,5-dimethylphenyl)carbonyl-1-[(4-nitrophenyl)methyl]-5-propan-2-yl-pyrimidine-2,4-dione

Systemtic Name: 6-(3,5-dimethylphenyl)carbonyl-1-[(4-nitrophenyl)methyl]-5-propan-2-yl-pyrimidine-2,4-dione Openeye Name: 6-(3,5-dimethylbenzoyl)-5-isopropyl-1-[(4-nitrophenyl)methyl]pyrimidine-2,4-dione CAS Name: 6-[(3,5-dimethylphenyl)-oxomethyl]-1-[(4-nitrophenyl)methyl]-5-propan-2-ylpyrimidine-2,4-dione IUPAC Name: 6-(3,5-dimethylbenzoyl)-1-[(4-nitrophenyl)methyl]-5-propan-2-ylpyrimidine-2,4-dione Traditional Name: 6-(3,5-dimethylbenzoyl)-5-isopropyl-1-(4-nitrobenzyl)pyrimidine-2,4-quinone Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)C2=C(C(=O)NC(=O)N2CC3=CC=C(C=C3)[N+](=O)[O-])C(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)C2=C(C(=O)NC(=O)N2CC3=CC=C(C=C3)[N+](=O)[O-])C(C)C)C

InChI

InChI=1S/C23H23N3O5/c1-13(2)19-20(21(27)17-10-14(3)9-15(4)11-17)25(23(29)24-22(19)28)12-16-5-7-18(8-6-16)26(30)31/h5-11,13H,12H2,1-4H3,(H,24,28,29)