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

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

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNCC1)C2=CC=C(C=C2)C=O

Isomeric SMILES

C[N+]1(CCNCC1)C2=CC=C(C=C2)C=O

InChI

InChI=1S/C12H17N2O/c1-14(8-6-13-7-9-14)12-4-2-11(10-15)3-5-12/h2-5,10,13H,6-9H2,1H3/q+1