1-[3-methoxy-4-[3-(4-methylpiperazine-1,4-diium-1-yl)propoxy]phenyl]ethanone

Systemtic Name: 1-[3-methoxy-4-[3-(4-methylpiperazine-1,4-diium-1-yl)propoxy]phenyl]ethanone Openeye Name: 1-[3-methoxy-4-[3-(4-methylpiperazine-1,4-diium-1-yl)propoxy]phenyl]ethanone CAS Name: 1-[3-methoxy-4-[3-(4-methyl-1-piperazine-1,4-diiumyl)propoxy]phenyl]ethanone IUPAC Name: 1-[3-methoxy-4-[3-(4-methylpiperazine-1,4-diium-1-yl)propoxy]phenyl]ethanone Traditional Name: 1-[3-methoxy-4-[3-(4-methylpiperazine-1,4-diium-1-yl)propoxy]phenyl]ethanone Formula: C17H28N2O3+2 MolecularWeight: 308.41582

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCCC[NH+]2CC[NH+](CC2)C)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCCC[NH+]2CC[NH+](CC2)C)OC

InChI

InChI=1S/C17H26N2O3/c1-14(20)15-5-6-16(17(13-15)21-3)22-12-4-7-19-10-8-18(2)9-11-19/h5-6,13H,4,7-12H2,1-3H3/p+2