(4-chloranyl-2-methyl-phenyl)-[(3S)-1-(2-hydroxyethyl)piperidin-1-ium-3-yl]methanone

Systemtic Name: (4-chloranyl-2-methyl-phenyl)-[(3S)-1-(2-hydroxyethyl)piperidin-1-ium-3-yl]methanone Openeye Name: (4-chloro-2-methyl-phenyl)-[(3S)-1-(2-hydroxyethyl)piperidin-1-ium-3-yl]methanone CAS Name: (4-chloro-2-methylphenyl)-[(3S)-1-(2-hydroxyethyl)-3-piperidin-1-iumyl]methanone IUPAC Name: (4-chloro-2-methylphenyl)-[(3S)-1-(2-hydroxyethyl)piperidin-1-ium-3-yl]methanone Traditional Name: (4-chloro-2-methyl-phenyl)-[(3S)-1-(2-hydroxyethyl)piperidin-1-ium-3-yl]methanone Formula: C15H21ClNO2+ MolecularWeight: 282.78574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)C(=O)C2CCC[NH+](C2)CCO

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)C(=O)[C@H]2CCC[NH+](C2)CCO

InChI

InChI=1S/C15H20ClNO2/c1-11-9-13(16)4-5-14(11)15(19)12-3-2-6-17(10-12)7-8-18/h4-5,9,12,18H,2-3,6-8,10H2,1H3/p+1/t12-/m0/s1