4-[(E)-2-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxy-phenyl]ethenyl]-1-methyl-pyridin-1-ium

Systemtic Name: 4-[(E)-2-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxy-phenyl]ethenyl]-1-methyl-pyridin-1-ium Openeye Name: 4-[(E)-2-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxy-phenyl]vinyl]-1-methyl-pyridin-1-ium CAS Name: 4-[(E)-2-[3-[(3,5-dimethyl-1-pyrazolyl)methyl]-4-methoxyphenyl]ethenyl]-1-methylpyridin-1-ium IUPAC Name: 4-[(E)-2-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]ethenyl]-1-methylpyridin-1-ium Traditional Name: 4-[(E)-2-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxy-phenyl]vinyl]-1-methyl-pyridin-1-ium Formula: C21H24N3O+ MolecularWeight: 334.43476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=C(C=CC(=C2)C=CC3=CC=[N+](C=C3)C)OC)C

Isomeric SMILES

CC1=CC(=NN1CC2=C(C=CC(=C2)/C=C/C3=CC=[N+](C=C3)C)OC)C

InChI

InChI=1S/C21H24N3O/c1-16-13-17(2)24(22-16)15-20-14-19(7-8-21(20)25-4)6-5-18-9-11-23(3)12-10-18/h5-14H,15H2,1-4H3/q+1/b6-5+