1-(2-methoxyphenyl)-3-[(2S)-2-piperidin-1-ium-1-ylpropyl]urea

Systemtic Name: 1-(2-methoxyphenyl)-3-[(2S)-2-piperidin-1-ium-1-ylpropyl]urea Openeye Name: 1-(2-methoxyphenyl)-3-[(2S)-2-piperidin-1-ium-1-ylpropyl]urea CAS Name: 1-(2-methoxyphenyl)-3-[(2S)-2-(1-piperidin-1-iumyl)propyl]urea IUPAC Name: 1-(2-methoxyphenyl)-3-[(2S)-2-piperidin-1-ium-1-ylpropyl]urea Traditional Name: 1-(2-methoxyphenyl)-3-[(2S)-2-piperidin-1-ium-1-ylpropyl]urea Formula: C16H26N3O2+ MolecularWeight: 292.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)NC1=CC=CC=C1OC)[NH+]2CCCCC2

Isomeric SMILES

C[C@@H](CNC(=O)NC1=CC=CC=C1OC)[NH+]2CCCCC2

InChI

InChI=1S/C16H25N3O2/c1-13(19-10-6-3-7-11-19)12-17-16(20)18-14-8-4-5-9-15(14)21-2/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3,(H2,17,18,20)/p+1/t13-/m0/s1