3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]-1-prop-2-ynyl-indole

Systemtic Name: 3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]-1-prop-2-ynyl-indole Openeye Name: 3-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]-1-prop-2-ynyl-indole CAS Name: 3-[(E)-2-(1-methyl-4-pyridin-1-iumyl)ethenyl]-1-prop-2-ynylindole IUPAC Name: 3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]-1-prop-2-ynylindole Traditional Name: 3-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]-1-propargyl-indole Formula: C19H17N2+ MolecularWeight: 273.35168

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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#C

Isomeric SMILES

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

InChI

InChI=1S/C19H17N2/c1-3-12-21-15-17(18-6-4-5-7-19(18)21)9-8-16-10-13-20(2)14-11-16/h1,4-11,13-15H,12H2,2H3/q+1