2-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-6-ethoxy-phenol

Systemtic Name: 2-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-6-ethoxy-phenol Openeye Name: 2-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-6-ethoxy-phenol CAS Name: 2-[[4-(2,3-dimethylphenyl)-1-piperazin-1-iumyl]methyl]-6-ethoxyphenol IUPAC Name: 2-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-6-ethoxyphenol Traditional Name: 2-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-6-ethoxy-phenol Formula: C21H29N2O2+ MolecularWeight: 341.46716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)C[NH+]2CCN(CC2)C3=CC=CC(=C3C)C

Isomeric SMILES

CCOC1=CC=CC(=C1O)C[NH+]2CCN(CC2)C3=CC=CC(=C3C)C

InChI

InChI=1S/C21H28N2O2/c1-4-25-20-10-6-8-18(21(20)24)15-22-11-13-23(14-12-22)19-9-5-7-16(2)17(19)3/h5-10,24H,4,11-15H2,1-3H3/p+1