1-[[4-(2,5-dimethylphenoxy)phenyl]methyl]piperazin-4-ium

Systemtic Name: 1-[[4-(2,5-dimethylphenoxy)phenyl]methyl]piperazin-4-ium Openeye Name: 1-[[4-(2,5-dimethylphenoxy)phenyl]methyl]piperazin-4-ium CAS Name: 1-[[4-(2,5-dimethylphenoxy)phenyl]methyl]piperazin-4-ium IUPAC Name: 1-[[4-(2,5-dimethylphenoxy)phenyl]methyl]piperazin-4-ium Traditional Name: 1-[4-(2,5-dimethylphenoxy)benzyl]piperazin-4-ium Formula: C19H25N2O+ MolecularWeight: 297.4146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=CC=C(C=C2)CN3CC[NH2+]CC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=CC=C(C=C2)CN3CC[NH2+]CC3

InChI

InChI=1S/C19H24N2O/c1-15-3-4-16(2)19(13-15)22-18-7-5-17(6-8-18)14-21-11-9-20-10-12-21/h3-8,13,20H,9-12,14H2,1-2H3/p+1