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

Systemtic Name: 3-[(4-methylpiperazin-4-ium-1-yl)methyl]benzaldehyde Openeye Name: 3-[(4-methylpiperazin-4-ium-1-yl)methyl]benzaldehyde CAS Name: 3-[(4-methyl-1-piperazin-4-iumyl)methyl]benzaldehyde IUPAC Name: 3-[(4-methylpiperazin-4-ium-1-yl)methyl]benzaldehyde Traditional Name: 3-[(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=CC(=C2)C=O

Isomeric SMILES

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

InChI

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