2-[3-(4-methylpiperazin-4-ium-1-yl)propoxy]benzaldehyde

Systemtic Name: 2-[3-(4-methylpiperazin-4-ium-1-yl)propoxy]benzaldehyde Openeye Name: 2-[3-(4-methylpiperazin-4-ium-1-yl)propoxy]benzaldehyde CAS Name: 2-[3-(4-methyl-1-piperazin-4-iumyl)propoxy]benzaldehyde IUPAC Name: 2-[3-(4-methylpiperazin-4-ium-1-yl)propoxy]benzaldehyde Traditional Name: 2-[3-(4-methylpiperazin-4-ium-1-yl)propoxy]benzaldehyde Formula: C15H23N2O2+ MolecularWeight: 263.35532

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCCOC2=CC=CC=C2C=O

Isomeric SMILES

C[NH+]1CCN(CC1)CCCOC2=CC=CC=C2C=O

InChI

InChI=1S/C15H22N2O2/c1-16-8-10-17(11-9-16)7-4-12-19-15-6-3-2-5-14(15)13-18/h2-3,5-6,13H,4,7-12H2,1H3/p+1