[1-(2-ethoxyethyl)-4-phenethyl-piperidin-1-ium-4-yl] propanoate

Systemtic Name: [1-(2-ethoxyethyl)-4-phenethyl-piperidin-1-ium-4-yl] propanoate Openeye Name: [1-(2-ethoxyethyl)-4-phenethyl-piperidin-1-ium-4-yl] propanoate CAS Name: propanoic acid [1-(2-ethoxyethyl)-4-phenethyl-4-piperidin-1-iumyl] ester IUPAC Name: [1-(2-ethoxyethyl)-4-phenethylpiperidin-1-ium-4-yl] propanoate Traditional Name: propionic acid [1-(2-ethoxyethyl)-4-phenethyl-piperidin-1-ium-4-yl] ester Formula: C20H32NO3+ MolecularWeight: 334.47298

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1(CC[NH+](CC1)CCOCC)CCC2=CC=CC=C2

Isomeric SMILES

CCC(=O)OC1(CC[NH+](CC1)CCOCC)CCC2=CC=CC=C2

InChI

InChI=1S/C20H31NO3/c1-3-19(22)24-20(11-10-18-8-6-5-7-9-18)12-14-21(15-13-20)16-17-23-4-2/h5-9H,3-4,10-17H2,1-2H3/p+1