1-[[2-(3-phenylpropoxy)phenyl]methyl]piperazin-4-ium

Systemtic Name: 1-[[2-(3-phenylpropoxy)phenyl]methyl]piperazin-4-ium Openeye Name: 1-[[2-(3-phenylpropoxy)phenyl]methyl]piperazin-4-ium CAS Name: 1-[[2-(3-phenylpropoxy)phenyl]methyl]piperazin-4-ium IUPAC Name: 1-[[2-(3-phenylpropoxy)phenyl]methyl]piperazin-4-ium Traditional Name: 1-[2-(3-phenylpropoxy)benzyl]piperazin-4-ium Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CC2=CC=CC=C2OCCCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH2+]1)CC2=CC=CC=C2OCCCC3=CC=CC=C3

InChI

InChI=1S/C20H26N2O/c1-2-7-18(8-3-1)9-6-16-23-20-11-5-4-10-19(20)17-22-14-12-21-13-15-22/h1-5,7-8,10-11,21H,6,9,12-17H2/p+1