(3-chlorophenyl)-[(3S)-1-[(2-hydroxyphenyl)methyl]piperidin-1-ium-3-yl]methanone

Systemtic Name: (3-chlorophenyl)-[(3S)-1-[(2-hydroxyphenyl)methyl]piperidin-1-ium-3-yl]methanone Openeye Name: (3-chlorophenyl)-[(3S)-1-[(2-hydroxyphenyl)methyl]piperidin-1-ium-3-yl]methanone CAS Name: (3-chlorophenyl)-[(3S)-1-[(2-hydroxyphenyl)methyl]-3-piperidin-1-iumyl]methanone IUPAC Name: (3-chlorophenyl)-[(3S)-1-[(2-hydroxyphenyl)methyl]piperidin-1-ium-3-yl]methanone Traditional Name: (3-chlorophenyl)-[(3S)-1-salicylpiperidin-1-ium-3-yl]methanone Formula: C19H21ClNO2+ MolecularWeight: 330.82854

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=CC=C2O)C(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=CC=C2O)C(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H20ClNO2/c20-17-8-3-6-14(11-17)19(23)16-7-4-10-21(13-16)12-15-5-1-2-9-18(15)22/h1-3,5-6,8-9,11,16,22H,4,7,10,12-13H2/p+1/t16-/m0/s1