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

Systemtic Name: 2-[(E)-2-(1H-indol-3-yl)ethenyl]-5-nitro-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-2-[(E)-2-(1H-indol-3-yl)vinyl]-5-nitro-1H-pyrimidin-6-one CAS Name: 4-hydroxy-2-[(E)-2-(1H-indol-3-yl)ethenyl]-5-nitro-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-2-[(E)-2-(1H-indol-3-yl)ethenyl]-5-nitro-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-2-[(E)-2-(1H-indol-3-yl)vinyl]-5-nitro-1H-pyrimidin-6-one Formula: C14H10N4O4 MolecularWeight: 298.2536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C=CC3=NC(=C(C(=O)N3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)/C=C/C3=NC(=C(C(=O)N3)[N+](=O)[O-])O

InChI

InChI=1S/C14H10N4O4/c19-13-12(18(21)22)14(20)17-11(16-13)6-5-8-7-15-10-4-2-1-3-9(8)10/h1-7,15H,(H2,16,17,19,20)/b6-5+