1-ethyl-4-[4-[4-(phenylmethyl)phenoxy]butyl]piperazin-4-ium

Systemtic Name: 1-ethyl-4-[4-[4-(phenylmethyl)phenoxy]butyl]piperazin-4-ium Openeye Name: 1-[4-(4-benzylphenoxy)butyl]-4-ethyl-piperazin-1-ium CAS Name: 1-ethyl-4-[4-[4-(phenylmethyl)phenoxy]butyl]piperazin-4-ium IUPAC Name: 1-[4-(4-benzylphenoxy)butyl]-4-ethylpiperazin-1-ium Traditional Name: 1-[4-(4-benzylphenoxy)butyl]-4-ethyl-piperazin-1-ium Formula: C23H33N2O+ MolecularWeight: 353.52092

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CC1)CCCCOC2=CC=C(C=C2)CC3=CC=CC=C3

Isomeric SMILES

CCN1CC[NH+](CC1)CCCCOC2=CC=C(C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C23H32N2O/c1-2-24-15-17-25(18-16-24)14-6-7-19-26-23-12-10-22(11-13-23)20-21-8-4-3-5-9-21/h3-5,8-13H,2,6-7,14-20H2,1H3/p+1