5-(4-nitrophenyl)-1-oxidanyl-3-(phenylmethyl)pyrazin-2-one

Systemtic Name: 5-(4-nitrophenyl)-1-oxidanyl-3-(phenylmethyl)pyrazin-2-one Openeye Name: 3-benzyl-1-hydroxy-5-(4-nitrophenyl)pyrazin-2-one CAS Name: 1-hydroxy-5-(4-nitrophenyl)-3-(phenylmethyl)-2-pyrazinone IUPAC Name: 3-benzyl-1-hydroxy-5-(4-nitrophenyl)pyrazin-2-one Traditional Name: 3-benzyl-1-hydroxy-5-(4-nitrophenyl)pyrazin-2-one Formula: C17H13N3O4 MolecularWeight: 323.30282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC(=CN(C2=O)O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC(=CN(C2=O)O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O4/c21-17-15(10-12-4-2-1-3-5-12)18-16(11-19(17)22)13-6-8-14(9-7-13)20(23)24/h1-9,11,22H,10H2