5-nitro-4-oxidanyl-2-[(E)-2-(3-prop-2-enoxyphenyl)ethenyl]-1H-pyrimidin-6-one

Systemtic Name: 5-nitro-4-oxidanyl-2-[(E)-2-(3-prop-2-enoxyphenyl)ethenyl]-1H-pyrimidin-6-one Openeye Name: 2-[(E)-2-(3-allyloxyphenyl)vinyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one CAS Name: 4-hydroxy-5-nitro-2-[(E)-2-(3-prop-2-enoxyphenyl)ethenyl]-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-5-nitro-2-[(E)-2-(3-prop-2-enoxyphenyl)ethenyl]-1H-pyrimidin-6-one Traditional Name: 2-[(E)-2-(3-allyloxyphenyl)vinyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one Formula: C15H13N3O5 MolecularWeight: 315.28082

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC(=C1)C=CC2=NC(=C(C(=O)N2)[N+](=O)[O-])O

Isomeric SMILES

C=CCOC1=CC=CC(=C1)/C=C/C2=NC(=C(C(=O)N2)[N+](=O)[O-])O

InChI

InChI=1S/C15H13N3O5/c1-2-8-23-11-5-3-4-10(9-11)6-7-12-16-14(19)13(18(21)22)15(20)17-12/h2-7,9H,1,8H2,(H2,16,17,19,20)/b7-6+