2-(4-methylpiperazin-4-ium-1-yl)benzaldehyde

Systemtic Name: 2-(4-methylpiperazin-4-ium-1-yl)benzaldehyde Openeye Name: 2-(4-methylpiperazin-4-ium-1-yl)benzaldehyde CAS Name: 2-(4-methyl-1-piperazin-4-iumyl)benzaldehyde IUPAC Name: 2-(4-methylpiperazin-4-ium-1-yl)benzaldehyde Traditional Name: 2-(4-methylpiperazin-4-ium-1-yl)benzaldehyde Formula: C12H17N2O+ MolecularWeight: 205.27618

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2C=O

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2C=O

InChI

InChI=1S/C12H16N2O/c1-13-6-8-14(9-7-13)12-5-3-2-4-11(12)10-15/h2-5,10H,6-9H2,1H3/p+1