2-(dimethylamino)-4-(4-methylpiperazin-4-ium-1-yl)-6-oxidanylidene-1,3-oxazine-5-carbonitrile

Systemtic Name: 2-(dimethylamino)-4-(4-methylpiperazin-4-ium-1-yl)-6-oxidanylidene-1,3-oxazine-5-carbonitrile Openeye Name: 2-(dimethylamino)-4-(4-methylpiperazin-4-ium-1-yl)-6-oxo-1,3-oxazine-5-carbonitrile CAS Name: 2-(dimethylamino)-4-(4-methyl-1-piperazin-4-iumyl)-6-oxo-1,3-oxazine-5-carbonitrile IUPAC Name: 2-(dimethylamino)-4-(4-methylpiperazin-4-ium-1-yl)-6-oxo-1,3-oxazine-5-carbonitrile Traditional Name: 2-(dimethylamino)-6-keto-4-(4-methylpiperazin-4-ium-1-yl)-1,3-oxazine-5-carbonitrile Formula: C12H18N5O2+ MolecularWeight: 264.30362

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C(=O)OC(=N2)N(C)C)C#N

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C(=O)OC(=N2)N(C)C)C#N

InChI

InChI=1S/C12H17N5O2/c1-15(2)12-14-10(9(8-13)11(18)19-12)17-6-4-16(3)5-7-17/h4-7H2,1-3H3/p+1