(2-ethoxypyridin-3-yl)-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (2-ethoxypyridin-3-yl)-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (2-ethoxy-3-pyridyl)-[4-(o-tolylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (2-ethoxy-3-pyridinyl)-[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (2-ethoxypyridin-3-yl)-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (2-ethoxy-3-pyridyl)-[4-(2-methylbenzyl)piperazin-4-ium-1-yl]methanone Formula: C20H26N3O2+ MolecularWeight: 340.43934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3C

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3C

InChI

InChI=1S/C20H25N3O2/c1-3-25-19-18(9-6-10-21-19)20(24)23-13-11-22(12-14-23)15-17-8-5-4-7-16(17)2/h4-10H,3,11-15H2,1-2H3/p+1