N-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]-3-nitro-benzamide Openeye Name: N-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]-3-nitro-benzamide CAS Name: N-[2-(4-methyl-1-piperazine-1,4-diiumyl)ethyl]-3-nitrobenzamide IUPAC Name: N-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]-3-nitrobenzamide Traditional Name: N-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]-3-nitro-benzamide Formula: C14H22N4O3+2 MolecularWeight: 294.34948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N4O3/c1-16-7-9-17(10-8-16)6-5-15-14(19)12-3-2-4-13(11-12)18(20)21/h2-4,11H,5-10H2,1H3,(H,15,19)/p+2