1-(3-chloranyl-4-methyl-phenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[2-(1-piperidin-1-iumyl)ethyl]urea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea Formula: C15H23ClN3O+ MolecularWeight: 296.81562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NCC[NH+]2CCCCC2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NCC[NH+]2CCCCC2)Cl

InChI

InChI=1S/C15H22ClN3O/c1-12-5-6-13(11-14(12)16)18-15(20)17-7-10-19-8-3-2-4-9-19/h5-6,11H,2-4,7-10H2,1H3,(H2,17,18,20)/p+1