6-[methyl-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]amino]-2,2-diphenyl-hexanenitrile

Systemtic Name: 6-[methyl-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]amino]-2,2-diphenyl-hexanenitrile Openeye Name: 6-[methyl-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]amino]-2,2-diphenyl-hexanenitrile CAS Name: 6-[methyl-[2-(4-methyl-4-morpholin-4-iumyl)ethyl]amino]-2,2-diphenylhexanenitrile IUPAC Name: 6-[methyl-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]amino]-2,2-diphenylhexanenitrile Traditional Name: 6-[methyl-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]amino]-2,2-diphenyl-hexanenitrile Formula: C26H36N3O+ MolecularWeight: 406.58354

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)CC[N+]3(CCOCC3)C

Isomeric SMILES

CN(CCCCC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)CC[N+]3(CCOCC3)C

InChI

InChI=1S/C26H36N3O/c1-28(17-18-29(2)19-21-30-22-20-29)16-10-9-15-26(23-27,24-11-5-3-6-12-24)25-13-7-4-8-14-25/h3-8,11-14H,9-10,15-22H2,1-2H3/q+1