ethyl (3R)-1-[2-(2,2-diphenylethenoxy)ethyl]piperidin-1-ium-3-carboxylate chloride

Systemtic Name: ethyl (3R)-1-[2-(2,2-diphenylethenoxy)ethyl]piperidin-1-ium-3-carboxylate chloride Openeye Name: ethyl (3R)-1-[2-(2,2-diphenylvinyloxy)ethyl]piperidin-1-ium-3-carboxylate chloride CAS Name: (3R)-1-[2-(2,2-diphenylethenoxy)ethyl]-3-piperidin-1-iumcarboxylic acid ethyl ester chloride IUPAC Name: ethyl (3R)-1-[2-(2,2-diphenylethenoxy)ethyl]piperidin-1-ium-3-carboxylate chloride Traditional Name: (3R)-1-[2-(2,2-diphenylvinyloxy)ethyl]piperidin-1-ium-3-carboxylic acid ethyl ester chloride Formula: C24H30ClNO3 MolecularWeight: 415.9529

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CCOC=C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CCOC(=O)[C@@H]1CCC[NH+](C1)CCOC=C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C24H29NO3.ClH/c1-2-28-24(26)22-14-9-15-25(18-22)16-17-27-19-23(20-10-5-3-6-11-20)21-12-7-4-8-13-21;/h3-8,10-13,19,22H,2,9,14-18H2,1H3;1H/t22-;/m1./s1