5-[(E)-2-nitroethenyl]-1-(phenylmethyl)pyrimidine-2,4-dione

Systemtic Name: 5-[(E)-2-nitroethenyl]-1-(phenylmethyl)pyrimidine-2,4-dione Openeye Name: 1-benzyl-5-[(E)-2-nitrovinyl]pyrimidine-2,4-dione CAS Name: 5-[(E)-2-nitroethenyl]-1-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: 1-benzyl-5-[(E)-2-nitroethenyl]pyrimidine-2,4-dione Traditional Name: 1-benzyl-5-[(E)-2-nitrovinyl]pyrimidine-2,4-quinone Formula: C13H11N3O4 MolecularWeight: 273.24414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=O)NC2=O)C=C[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=O)NC2=O)/C=C/[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O4/c17-12-11(6-7-16(19)20)9-15(13(18)14-12)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H,14,17,18)/b7-6+