4-[(4-methylpiperazin-4-ium-1-yl)methyl]benzaldehyde

Systemtic Name: 4-[(4-methylpiperazin-4-ium-1-yl)methyl]benzaldehyde Openeye Name: 4-[(4-methylpiperazin-4-ium-1-yl)methyl]benzaldehyde CAS Name: 4-[(4-methyl-1-piperazin-4-iumyl)methyl]benzaldehyde IUPAC Name: 4-[(4-methylpiperazin-4-ium-1-yl)methyl]benzaldehyde Traditional Name: 4-[(4-methylpiperazin-4-ium-1-yl)methyl]benzaldehyde Formula: C13H19N2O+ MolecularWeight: 219.30276

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC2=CC=C(C=C2)C=O

Isomeric SMILES

C[NH+]1CCN(CC1)CC2=CC=C(C=C2)C=O

InChI

InChI=1S/C13H18N2O/c1-14-6-8-15(9-7-14)10-12-2-4-13(11-16)5-3-12/h2-5,11H,6-10H2,1H3/p+1