6-nitro-4-[2-oxidanylidene-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-nitro-4-[2-oxidanylidene-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]-1,4-benzoxazin-3-one Openeye Name: 6-nitro-4-[2-oxo-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]-1,4-benzoxazin-3-one CAS Name: 6-nitro-4-[2-oxo-2-[4-(2-pyrazinyl)-1-piperazinyl]ethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-nitro-4-[2-oxo-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]-1,4-benzoxazin-3-one Traditional Name: 4-[2-keto-2-(4-pyrazin-2-ylpiperazino)ethyl]-6-nitro-1,4-benzoxazin-3-one Formula: C18H18N6O5 MolecularWeight: 398.37272

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CN=C2)C(=O)CN3C(=O)COC4=C3C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=NC=CN=C2)C(=O)CN3C(=O)COC4=C3C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H18N6O5/c25-17(22-7-5-21(6-8-22)16-10-19-3-4-20-16)11-23-14-9-13(24(27)28)1-2-15(14)29-12-18(23)26/h1-4,9-10H,5-8,11-12H2