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

Systemtic Name: 3-methyl-4-(4-methylpiperazin-4-ium-1-yl)benzaldehyde Openeye Name: 3-methyl-4-(4-methylpiperazin-4-ium-1-yl)benzaldehyde CAS Name: 3-methyl-4-(4-methyl-1-piperazin-4-iumyl)benzaldehyde IUPAC Name: 3-methyl-4-(4-methylpiperazin-4-ium-1-yl)benzaldehyde Traditional Name: 3-methyl-4-(4-methylpiperazin-4-ium-1-yl)benzaldehyde Formula: C13H19N2O+ MolecularWeight: 219.30276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C=O)N2CC[NH+](CC2)C

Isomeric SMILES

CC1=C(C=CC(=C1)C=O)N2CC[NH+](CC2)C

InChI

InChI=1S/C13H18N2O/c1-11-9-12(10-16)3-4-13(11)15-7-5-14(2)6-8-15/h3-4,9-10H,5-8H2,1-2H3/p+1