3-[methyl-[4-[2-(1,3,3-trimethylindol-1-ium-2-yl)ethyl]phenyl]amino]propanenitrile

Systemtic Name: 3-[methyl-[4-[2-(1,3,3-trimethylindol-1-ium-2-yl)ethyl]phenyl]amino]propanenitrile Openeye Name: 3-[N-methyl-4-[2-(1,3,3-trimethylindol-1-ium-2-yl)ethyl]anilino]propanenitrile CAS Name: 3-[N-methyl-4-[2-(1,3,3-trimethyl-2-indol-1-iumyl)ethyl]anilino]propanenitrile IUPAC Name: 3-[N-methyl-4-[2-(1,3,3-trimethylindol-1-ium-2-yl)ethyl]anilino]propanenitrile Traditional Name: 3-[N-methyl-4-[2-(1,3,3-trimethylindol-1-ium-2-yl)ethyl]anilino]propionitrile Formula: C23H28N3+ MolecularWeight: 346.48852

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2[N+](=C1CCC3=CC=C(C=C3)N(C)CCC#N)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2[N+](=C1CCC3=CC=C(C=C3)N(C)CCC#N)C)C

InChI

InChI=1S/C23H28N3/c1-23(2)20-8-5-6-9-21(20)26(4)22(23)15-12-18-10-13-19(14-11-18)25(3)17-7-16-24/h5-6,8-11,13-14H,7,12,15,17H2,1-4H3/q+1