methyl 2-[3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]indol-1-yl]ethanoate

Systemtic Name: methyl 2-[3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]indol-1-yl]ethanoate Openeye Name: methyl 2-[3-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]indol-1-yl]acetate CAS Name: 2-[3-[(E)-2-(1-methyl-4-pyridin-1-iumyl)ethenyl]-1-indolyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]indol-1-yl]acetate Traditional Name: 2-[3-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]indol-1-yl]acetic acid methyl ester Formula: C19H19N2O2+ MolecularWeight: 307.36636

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C=CC2=CN(C3=CC=CC=C32)CC(=O)OC

Isomeric SMILES

C[N+]1=CC=C(C=C1)/C=C/C2=CN(C3=CC=CC=C32)CC(=O)OC

InChI

InChI=1S/C19H19N2O2/c1-20-11-9-15(10-12-20)7-8-16-13-21(14-19(22)23-2)18-6-4-3-5-17(16)18/h3-13H,14H2,1-2H3/q+1