2-(dimethylamino)-N-(4-methylpiperazin-4-ium-1-yl)-5-nitro-benzamide

Systemtic Name: 2-(dimethylamino)-N-(4-methylpiperazin-4-ium-1-yl)-5-nitro-benzamide Openeye Name: 2-(dimethylamino)-N-(4-methylpiperazin-4-ium-1-yl)-5-nitro-benzamide CAS Name: 2-(dimethylamino)-N-(4-methyl-1-piperazin-4-iumyl)-5-nitrobenzamide IUPAC Name: 2-(dimethylamino)-N-(4-methylpiperazin-4-ium-1-yl)-5-nitrobenzamide Traditional Name: 2-(dimethylamino)-N-(4-methylpiperazin-4-ium-1-yl)-5-nitro-benzamide Formula: C14H22N5O3+ MolecularWeight: 308.35618

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N(C)C

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N(C)C

InChI

InChI=1S/C14H21N5O3/c1-16(2)13-5-4-11(19(21)22)10-12(13)14(20)15-18-8-6-17(3)7-9-18/h4-5,10H,6-9H2,1-3H3,(H,15,20)/p+1