[4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]-pyridin-3-yl-methanone Openeye Name: [4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]-(3-pyridyl)methanone CAS Name: [4-[(4-ethoxyphenyl)methyl]-1-piperazin-4-iumyl]-(3-pyridinyl)methanone IUPAC Name: [4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]-pyridin-3-ylmethanone Traditional Name: [4-(4-ethoxybenzyl)piperazin-4-ium-1-yl]-(3-pyridyl)methanone Formula: C19H24N3O2+ MolecularWeight: 326.41276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CN=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H23N3O2/c1-2-24-18-7-5-16(6-8-18)15-21-10-12-22(13-11-21)19(23)17-4-3-9-20-14-17/h3-9,14H,2,10-13,15H2,1H3/p+1