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

Systemtic Name: 6-nitro-4-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-benzoxazin-3-one Openeye Name: 6-nitro-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-benzoxazin-3-one CAS Name: 6-nitro-4-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-nitro-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-benzoxazin-3-one Traditional Name: 4-[2-keto-2-(4-phenylpiperazino)ethyl]-6-nitro-1,4-benzoxazin-3-one Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4O5/c25-19(22-10-8-21(9-11-22)15-4-2-1-3-5-15)13-23-17-12-16(24(27)28)6-7-18(17)29-14-20(23)26/h1-7,12H,8-11,13-14H2