[2-[(E)-2-(4-dimethylaminophenyl)ethenyl]pyridin-1-ium-1-yl] ethanoate perchlorate

Systemtic Name: [2-[(E)-2-(4-dimethylaminophenyl)ethenyl]pyridin-1-ium-1-yl] ethanoate perchlorate Openeye Name: [2-[(E)-2-(4-dimethylaminophenyl)vinyl]pyridin-1-ium-1-yl] acetate perchlorate CAS Name: acetic acid [2-[(E)-2-(4-dimethylaminophenyl)ethenyl]-1-pyridin-1-iumyl] ester perchlorate IUPAC Name: [2-[(E)-2-(4-dimethylaminophenyl)ethenyl]pyridin-1-ium-1-yl] acetate perchlorate Traditional Name: acetic acid [2-[(E)-2-(4-dimethylaminophenyl)vinyl]pyridin-1-ium-1-yl] ester perchlorate Formula: C17H19ClN2O6 MolecularWeight: 382.79556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O[N+]1=CC=CC=C1C=CC2=CC=C(C=C2)N(C)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(=O)O[N+]1=CC=CC=C1/C=C/C2=CC=C(C=C2)N(C)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C17H19N2O2.ClHO4/c1-14(20)21-19-13-5-4-6-17(19)12-9-15-7-10-16(11-8-15)18(2)3;2-1(3,4)5/h4-13H,1-3H3;(H,2,3,4,5)/q+1;/p-1