5-nitro-4-oxidanyl-2-[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]-1H-pyrimidin-6-one

Systemtic Name: 5-nitro-4-oxidanyl-2-[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-5-nitro-2-[(E)-2-(4-pyrrolidin-1-ylphenyl)vinyl]-1H-pyrimidin-6-one CAS Name: 4-hydroxy-5-nitro-2-[(E)-2-[4-(1-pyrrolidinyl)phenyl]ethenyl]-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-5-nitro-2-[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-5-nitro-2-[(E)-2-(4-pyrrolidinophenyl)vinyl]-1H-pyrimidin-6-one Formula: C16H16N4O4 MolecularWeight: 328.32264

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)C=CC3=NC(=C(C(=O)N3)[N+](=O)[O-])O

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)/C=C/C3=NC(=C(C(=O)N3)[N+](=O)[O-])O

InChI

InChI=1S/C16H16N4O4/c21-15-14(20(23)24)16(22)18-13(17-15)8-5-11-3-6-12(7-4-11)19-9-1-2-10-19/h3-8H,1-2,9-10H2,(H2,17,18,21,22)/b8-5+