1-(2-ethylphenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea

Systemtic Name: 1-(2-ethylphenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea Openeye Name: 1-(2-ethylphenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea CAS Name: 1-(2-ethylphenyl)-3-[2-(1-piperidin-1-iumyl)ethyl]urea IUPAC Name: 1-(2-ethylphenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea Traditional Name: 1-(2-ethylphenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea Formula: C16H26N3O+ MolecularWeight: 276.39714

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)NCC[NH+]2CCCCC2

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)NCC[NH+]2CCCCC2

InChI

InChI=1S/C16H25N3O/c1-2-14-8-4-5-9-15(14)18-16(20)17-10-13-19-11-6-3-7-12-19/h4-5,8-9H,2-3,6-7,10-13H2,1H3,(H2,17,18,20)/p+1