3-[(1-methylpiperazin-1-ium-1-yl)methyl]phenol

Systemtic Name: 3-[(1-methylpiperazin-1-ium-1-yl)methyl]phenol Openeye Name: 3-[(1-methylpiperazin-1-ium-1-yl)methyl]phenol CAS Name: 3-[(1-methyl-1-piperazin-1-iumyl)methyl]phenol IUPAC Name: 3-[(1-methylpiperazin-1-ium-1-yl)methyl]phenol Traditional Name: 3-[(1-methylpiperazin-1-ium-1-yl)methyl]phenol Formula: C12H19N2O+ MolecularWeight: 207.29206

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNCC1)CC2=CC(=CC=C2)O

Isomeric SMILES

C[N+]1(CCNCC1)CC2=CC(=CC=C2)O

InChI

InChI=1S/C12H18N2O/c1-14(7-5-13-6-8-14)10-11-3-2-4-12(15)9-11/h2-4,9,13H,5-8,10H2,1H3/p+1