N-[1-[2-(2,5-dimethoxyphenyl)-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]cyclohexanecarboxamide

Systemtic Name: N-[1-[2-(2,5-dimethoxyphenyl)-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]cyclohexanecarboxamide Openeye Name: N-[1-[2-(2,5-dimethoxyphenyl)-2-oxo-ethyl]piperidin-1-ium-4-yl]cyclohexanecarboxamide CAS Name: N-[1-[2-(2,5-dimethoxyphenyl)-2-oxoethyl]-4-piperidin-1-iumyl]cyclohexanecarboxamide IUPAC Name: N-[1-[2-(2,5-dimethoxyphenyl)-2-oxoethyl]piperidin-1-ium-4-yl]cyclohexanecarboxamide Traditional Name: N-[1-[2-(2,5-dimethoxyphenyl)-2-keto-ethyl]piperidin-1-ium-4-yl]cyclohexanecarboxamide Formula: C22H33N2O4+ MolecularWeight: 389.50842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)C[NH+]2CCC(CC2)NC(=O)C3CCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)C[NH+]2CCC(CC2)NC(=O)C3CCCCC3

InChI

InChI=1S/C22H32N2O4/c1-27-18-8-9-21(28-2)19(14-18)20(25)15-24-12-10-17(11-13-24)23-22(26)16-6-4-3-5-7-16/h8-9,14,16-17H,3-7,10-13,15H2,1-2H3,(H,23,26)/p+1