N-[1-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-2-ethoxy-benzamide

Systemtic Name: N-[1-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-2-ethoxy-benzamide Openeye Name: N-[1-[2-(cyclohexylamino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-2-ethoxy-benzamide CAS Name: N-[1-[2-(cyclohexylamino)-2-oxoethyl]-4-piperidin-1-iumyl]-2-ethoxybenzamide IUPAC Name: N-[1-[2-(cyclohexylamino)-2-oxoethyl]piperidin-1-ium-4-yl]-2-ethoxybenzamide Traditional Name: N-[1-[2-(cyclohexylamino)-2-keto-ethyl]piperidin-1-ium-4-yl]-2-ethoxy-benzamide Formula: C22H34N3O3+ MolecularWeight: 388.52366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NC2CC[NH+](CC2)CC(=O)NC3CCCCC3

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)NC2CC[NH+](CC2)CC(=O)NC3CCCCC3

InChI

InChI=1S/C22H33N3O3/c1-2-28-20-11-7-6-10-19(20)22(27)24-18-12-14-25(15-13-18)16-21(26)23-17-8-4-3-5-9-17/h6-7,10-11,17-18H,2-5,8-9,12-16H2,1H3,(H,23,26)(H,24,27)/p+1