(3R,6R)-6-(2,2-diphenylethenoxymethyl)piperidin-1-ium-3-carboxylic acid chloride

Systemtic Name: (3R,6R)-6-(2,2-diphenylethenoxymethyl)piperidin-1-ium-3-carboxylic acid chloride Openeye Name: (3R,6R)-6-(2,2-diphenylvinyloxymethyl)piperidin-1-ium-3-carboxylic acid chloride CAS Name: (3R,6R)-6-(2,2-diphenylethenoxymethyl)-3-piperidin-1-iumcarboxylic acid chloride IUPAC Name: (3R,6R)-6-(2,2-diphenylethenoxymethyl)piperidin-1-ium-3-carboxylic acid chloride Traditional Name: (3R,6R)-6-(2,2-diphenylvinyloxymethyl)piperidin-1-ium-3-carboxylic acid chloride Formula: C21H24ClNO3 MolecularWeight: 373.87316

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]CC1C(=O)O)COC=C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1C[C@@H]([NH2+]C[C@@H]1C(=O)O)COC=C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C21H23NO3.ClH/c23-21(24)18-11-12-19(22-13-18)14-25-15-20(16-7-3-1-4-8-16)17-9-5-2-6-10-17;/h1-10,15,18-19,22H,11-14H2,(H,23,24);1H/t18-,19-;/m1./s1