1-[4-(2-methylphenoxy)butyl]-4-(phenylmethyl)piperazin-1-ium

Systemtic Name: 1-[4-(2-methylphenoxy)butyl]-4-(phenylmethyl)piperazin-1-ium Openeye Name: 1-benzyl-4-[4-(2-methylphenoxy)butyl]piperazin-4-ium CAS Name: 1-[4-(2-methylphenoxy)butyl]-4-(phenylmethyl)piperazin-1-ium IUPAC Name: 1-benzyl-4-[4-(2-methylphenoxy)butyl]piperazin-4-ium Traditional Name: 1-benzyl-4-[4-(2-methylphenoxy)butyl]piperazin-4-ium Formula: C22H31N2O+ MolecularWeight: 339.49434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCC[NH+]2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1OCCCC[NH+]2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H30N2O/c1-20-9-5-6-12-22(20)25-18-8-7-13-23-14-16-24(17-15-23)19-21-10-3-2-4-11-21/h2-6,9-12H,7-8,13-19H2,1H3/p+1