1-[3-(2-chloranyl-5-methyl-phenoxy)propyl]piperidin-1-ium-4-one

Systemtic Name: 1-[3-(2-chloranyl-5-methyl-phenoxy)propyl]piperidin-1-ium-4-one Openeye Name: 1-[3-(2-chloro-5-methyl-phenoxy)propyl]piperidin-1-ium-4-one CAS Name: 1-[3-(2-chloro-5-methylphenoxy)propyl]-4-piperidin-1-iumone IUPAC Name: 1-[3-(2-chloro-5-methylphenoxy)propyl]piperidin-1-ium-4-one Traditional Name: 1-[3-(2-chloro-5-methyl-phenoxy)propyl]piperidin-1-ium-4-one Formula: C15H21ClNO2+ MolecularWeight: 282.78574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OCCC[NH+]2CCC(=O)CC2

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OCCC[NH+]2CCC(=O)CC2

InChI

InChI=1S/C15H20ClNO2/c1-12-3-4-14(16)15(11-12)19-10-2-7-17-8-5-13(18)6-9-17/h3-4,11H,2,5-10H2,1H3/p+1