1-[[(3R)-1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-1-methyl-3-propyl-urea

Systemtic Name: 1-[[(3R)-1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-1-methyl-3-propyl-urea Openeye Name: 1-[[(3R)-1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-1-methyl-3-propyl-urea CAS Name: 1-[[(3R)-1-[2-(2-methoxyphenyl)ethyl]-3-piperidin-1-iumyl]methyl]-1-methyl-3-propylurea IUPAC Name: 1-[[(3R)-1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-1-methyl-3-propylurea Traditional Name: 1-[[(3R)-1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-1-methyl-3-propyl-urea Formula: C20H34N3O2+ MolecularWeight: 348.50286

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N(C)CC1CCC[NH+](C1)CCC2=CC=CC=C2OC

Isomeric SMILES

CCCNC(=O)N(C)C[C@H]1CCC[NH+](C1)CCC2=CC=CC=C2OC

InChI

InChI=1S/C20H33N3O2/c1-4-12-21-20(24)22(2)15-17-8-7-13-23(16-17)14-11-18-9-5-6-10-19(18)25-3/h5-6,9-10,17H,4,7-8,11-16H2,1-3H3,(H,21,24)/p+1/t17-/m1/s1