N-(4-methylpiperazin-4-ium-1-yl)-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-(4-methylpiperazin-4-ium-1-yl)-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-(4-methylpiperazin-4-ium-1-yl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-(4-methyl-1-piperazin-4-iumyl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-(4-methylpiperazin-4-ium-1-yl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: 2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)-N-(4-methylpiperazin-4-ium-1-yl)acetamide Formula: C15H20N5O5+ MolecularWeight: 350.3498

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H19N5O5/c1-17-4-6-18(7-5-17)16-14(21)9-19-12-8-11(20(23)24)2-3-13(12)25-10-15(19)22/h2-3,8H,4-7,9-10H2,1H3,(H,16,21)/p+1