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

Systemtic Name: 3-methoxy-2-[3-(4-methylpiperazin-4-ium-1-yl)propoxy]benzaldehyde Openeye Name: 3-methoxy-2-[3-(4-methylpiperazin-4-ium-1-yl)propoxy]benzaldehyde CAS Name: 3-methoxy-2-[3-(4-methyl-1-piperazin-4-iumyl)propoxy]benzaldehyde IUPAC Name: 3-methoxy-2-[3-(4-methylpiperazin-4-ium-1-yl)propoxy]benzaldehyde Traditional Name: 3-methoxy-2-[3-(4-methylpiperazin-4-ium-1-yl)propoxy]benzaldehyde Formula: C16H25N2O3+ MolecularWeight: 293.3813

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCCOC2=C(C=CC=C2OC)C=O

Isomeric SMILES

C[NH+]1CCN(CC1)CCCOC2=C(C=CC=C2OC)C=O

InChI

InChI=1S/C16H24N2O3/c1-17-8-10-18(11-9-17)7-4-12-21-16-14(13-19)5-3-6-15(16)20-2/h3,5-6,13H,4,7-12H2,1-2H3/p+1