N-[1-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[1-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[1-[2-(cyclohexylamino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-3,4,5-trimethoxy-benzamide CAS Name: N-[1-[2-(cyclohexylamino)-2-oxoethyl]-4-piperidin-1-iumyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[1-[2-(cyclohexylamino)-2-oxoethyl]piperidin-1-ium-4-yl]-3,4,5-trimethoxybenzamide Traditional Name: N-[1-[2-(cyclohexylamino)-2-keto-ethyl]piperidin-1-ium-4-yl]-3,4,5-trimethoxy-benzamide Formula: C23H36N3O5+ MolecularWeight: 434.54904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC2CC[NH+](CC2)CC(=O)NC3CCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC2CC[NH+](CC2)CC(=O)NC3CCCCC3

InChI

InChI=1S/C23H35N3O5/c1-29-19-13-16(14-20(30-2)22(19)31-3)23(28)25-18-9-11-26(12-10-18)15-21(27)24-17-7-5-4-6-8-17/h13-14,17-18H,4-12,15H2,1-3H3,(H,24,27)(H,25,28)/p+1