1-[(2,5-dimethylphenyl)methyl]-4-(2-ethoxyphenyl)piperazin-1-ium

Systemtic Name: 1-[(2,5-dimethylphenyl)methyl]-4-(2-ethoxyphenyl)piperazin-1-ium Openeye Name: 1-[(2,5-dimethylphenyl)methyl]-4-(2-ethoxyphenyl)piperazin-1-ium CAS Name: 1-[(2,5-dimethylphenyl)methyl]-4-(2-ethoxyphenyl)piperazin-1-ium IUPAC Name: 1-[(2,5-dimethylphenyl)methyl]-4-(2-ethoxyphenyl)piperazin-1-ium Traditional Name: 1-(2,5-dimethylbenzyl)-4-o-phenetyl-piperazin-1-ium Formula: C21H29N2O+ MolecularWeight: 325.46776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C21H28N2O/c1-4-24-21-8-6-5-7-20(21)23-13-11-22(12-14-23)16-19-15-17(2)9-10-18(19)3/h5-10,15H,4,11-14,16H2,1-3H3/p+1