4-[2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-[2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one Openeye Name: 4-[2-[4-(6-nitro-3-pyridyl)piperazin-1-yl]-2-oxo-ethyl]-1,4-benzoxazin-3-one CAS Name: 4-[2-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-2-oxoethyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one Traditional Name: 4-[2-keto-2-[4-(6-nitro-3-pyridyl)piperazino]ethyl]-1,4-benzoxazin-3-one Formula: C19H19N5O5 MolecularWeight: 397.38466

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CN=C(C=C2)[N+](=O)[O-])C(=O)CN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=CN=C(C=C2)[N+](=O)[O-])C(=O)CN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C19H19N5O5/c25-18(12-23-15-3-1-2-4-16(15)29-13-19(23)26)22-9-7-21(8-10-22)14-5-6-17(20-11-14)24(27)28/h1-6,11H,7-10,12-13H2