4-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-1-(2-piperidin-1-ylethyl)pyridin-1-ium

Systemtic Name: 4-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-1-(2-piperidin-1-ylethyl)pyridin-1-ium Openeye Name: 4-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-1-[2-(1-piperidyl)ethyl]pyridin-1-ium CAS Name: 4-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-1-[2-(1-piperidinyl)ethyl]pyridin-1-ium IUPAC Name: 4-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-1-(2-piperidin-1-ylethyl)pyridin-1-ium Traditional Name: 4-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-1-(2-piperidinoethyl)pyridin-1-ium Formula: C22H29N2O2+ MolecularWeight: 353.47786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC2=CC=[N+](C=C2)CCN3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C2=CC=[N+](C=C2)CCN3CCCCC3)OC

InChI

InChI=1S/C22H29N2O2/c1-25-21-9-8-20(18-22(21)26-2)7-6-19-10-14-24(15-11-19)17-16-23-12-4-3-5-13-23/h6-11,14-15,18H,3-5,12-13,16-17H2,1-2H3/q+1/b7-6+