5-fluoranyl-1-[(4-methoxy-3-nitro-phenyl)methyl]-3-(3-methylbutyl)pyrimidine-2,4-dione

Systemtic Name: 5-fluoranyl-1-[(4-methoxy-3-nitro-phenyl)methyl]-3-(3-methylbutyl)pyrimidine-2,4-dione Openeye Name: 5-fluoro-3-isopentyl-1-[(4-methoxy-3-nitro-phenyl)methyl]pyrimidine-2,4-dione CAS Name: 5-fluoro-1-[(4-methoxy-3-nitrophenyl)methyl]-3-(3-methylbutyl)pyrimidine-2,4-dione IUPAC Name: 5-fluoro-1-[(4-methoxy-3-nitrophenyl)methyl]-3-(3-methylbutyl)pyrimidine-2,4-dione Traditional Name: 5-fluoro-3-isoamyl-1-(4-methoxy-3-nitro-benzyl)pyrimidine-2,4-quinone Formula: C17H20FN3O5 MolecularWeight: 365.356203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C(=CN(C1=O)CC2=CC(=C(C=C2)OC)[N+](=O)[O-])F

Isomeric SMILES

CC(C)CCN1C(=O)C(=CN(C1=O)CC2=CC(=C(C=C2)OC)[N+](=O)[O-])F

InChI

InChI=1S/C17H20FN3O5/c1-11(2)6-7-20-16(22)13(18)10-19(17(20)23)9-12-4-5-15(26-3)14(8-12)21(24)25/h4-5,8,10-11H,6-7,9H2,1-3H3