3-(2,2,8-trimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-2-ium-5-yl)propanenitrile iodide

Systemtic Name: 3-(2,2,8-trimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-2-ium-5-yl)propanenitrile iodide Openeye Name: 3-(2,2,8-trimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-2-ium-5-yl)propanenitrile iodide CAS Name: 3-(2,2,8-trimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-2-ium-5-yl)propanenitrile iodide IUPAC Name: 3-(2,2,8-trimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-2-ium-5-yl)propanenitrile iodide Traditional Name: 3-(2,2,8-trimethyl-3,4-dihydro-1H-pyrid[4,3-b]indol-2-ium-5-yl)propionitrile iodide Formula: C17H22IN3 MolecularWeight: 395.28115

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C3=C2C[N+](CC3)(C)C)CCC#N.[I-]

Isomeric SMILES

CC1=CC2=C(C=C1)N(C3=C2C[N+](CC3)(C)C)CCC#N.[I-]

InChI

InChI=1S/C17H22N3.HI/c1-13-5-6-16-14(11-13)15-12-20(2,3)10-7-17(15)19(16)9-4-8-18;/h5-6,11H,4,7,9-10,12H2,1-3H3;1H/q+1;/p-1