2-[(E)-2-(5-bromanyl-1H-indol-3-yl)ethenyl]-5-nitro-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[(E)-2-(5-bromanyl-1H-indol-3-yl)ethenyl]-5-nitro-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-[(E)-2-(5-bromo-1H-indol-3-yl)vinyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one CAS Name: 2-[(E)-2-(5-bromo-1H-indol-3-yl)ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one IUPAC Name: 2-[(E)-2-(5-bromo-1H-indol-3-yl)ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one Traditional Name: 2-[(E)-2-(5-bromo-1H-indol-3-yl)vinyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one Formula: C14H9BrN4O4 MolecularWeight: 377.14966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=CN2)C=CC3=NC(=C(C(=O)N3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC2=C(C=C1Br)C(=CN2)/C=C/C3=NC(=C(C(=O)N3)[N+](=O)[O-])O

InChI

InChI=1S/C14H9BrN4O4/c15-8-2-3-10-9(5-8)7(6-16-10)1-4-11-17-13(20)12(19(22)23)14(21)18-11/h1-6,16H,(H2,17,18,20,21)/b4-1+