1-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-4-(3-methoxyphenyl)-1-methyl-piperidin-1-ium-4-carbonitrile

Systemtic Name: 1-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-4-(3-methoxyphenyl)-1-methyl-piperidin-1-ium-4-carbonitrile Openeye Name: 1-[2-(4-chlorophenyl)-2-oxo-ethyl]-4-(3-methoxyphenyl)-1-methyl-piperidin-1-ium-4-carbonitrile CAS Name: 1-[2-(4-chlorophenyl)-2-oxoethyl]-4-(3-methoxyphenyl)-1-methyl-4-piperidin-1-iumcarbonitrile IUPAC Name: 1-[2-(4-chlorophenyl)-2-oxoethyl]-4-(3-methoxyphenyl)-1-methylpiperidin-1-ium-4-carbonitrile Traditional Name: 1-[2-(4-chlorophenyl)-2-keto-ethyl]-4-(3-methoxyphenyl)-1-methyl-piperidin-1-ium-4-carbonitrile Formula: C22H24ClN2O2+ MolecularWeight: 383.89116

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)(C#N)C2=CC(=CC=C2)OC)CC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C[N+]1(CCC(CC1)(C#N)C2=CC(=CC=C2)OC)CC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H24ClN2O2/c1-25(15-21(26)17-6-8-19(23)9-7-17)12-10-22(16-24,11-13-25)18-4-3-5-20(14-18)27-2/h3-9,14H,10-13,15H2,1-2H3/q+1