N-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]pyren-1-amine

Systemtic Name: N-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]pyren-1-amine Openeye Name: N-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)vinyl]pyren-1-amine CAS Name: N-[(E)-2-(1,3,3-trimethyl-2-indol-1-iumyl)ethenyl]-1-pyrenamine IUPAC Name: N-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]pyren-1-amine Traditional Name: pyren-1-yl-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)vinyl]amine Formula: C29H25N2+ MolecularWeight: 401.5222

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2[N+](=C1C=CNC3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=C3)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2[N+](=C1/C=C/NC3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=C3)C)C

InChI

InChI=1S/C29H24N2/c1-29(2)23-9-4-5-10-25(23)31(3)26(29)17-18-30-24-16-14-21-12-11-19-7-6-8-20-13-15-22(24)28(21)27(19)20/h4-18H,1-3H3/p+1