2-[2,6-bis[(E)-2-(1-methylindol-3-yl)ethenyl]pyridin-1-ium-1-yl]ethanamine

Systemtic Name: 2-[2,6-bis[(E)-2-(1-methylindol-3-yl)ethenyl]pyridin-1-ium-1-yl]ethanamine Openeye Name: 2-[2,6-bis[(E)-2-(1-methylindol-3-yl)vinyl]pyridin-1-ium-1-yl]ethanamine CAS Name: 2-[2,6-bis[(E)-2-(1-methyl-3-indolyl)ethenyl]-1-pyridin-1-iumyl]ethanamine IUPAC Name: 2-[2,6-bis[(E)-2-(1-methylindol-3-yl)ethenyl]pyridin-1-ium-1-yl]ethanamine Traditional Name: 2-[2,6-bis[(E)-2-(1-methylindol-3-yl)vinyl]pyridin-1-ium-1-yl]ethylamine Formula: C29H29N4+ MolecularWeight: 433.56736

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C=CC3=[N+](C(=CC=C3)C=CC4=CN(C5=CC=CC=C54)C)CCN

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)/C=C/C3=[N+](C(=CC=C3)/C=C/C4=CN(C5=CC=CC=C54)C)CCN

InChI

InChI=1S/C29H29N4/c1-31-20-22(26-10-3-5-12-28(26)31)14-16-24-8-7-9-25(33(24)19-18-30)17-15-23-21-32(2)29-13-6-4-11-27(23)29/h3-17,20-21H,18-19,30H2,1-2H3/q+1