2-pyrrolidin-1-ylethyl 2-(2,5-dimethylphenyl)-2-oxidanyl-2-phenyl-ethanoate hydrochloride

Systemtic Name: 2-pyrrolidin-1-ylethyl 2-(2,5-dimethylphenyl)-2-oxidanyl-2-phenyl-ethanoate hydrochloride Openeye Name: 2-pyrrolidin-1-ylethyl 2-(2,5-dimethylphenyl)-2-hydroxy-2-phenyl-acetate hydrochloride CAS Name: 2-(2,5-dimethylphenyl)-2-hydroxy-2-phenylacetic acid 2-(1-pyrrolidinyl)ethyl ester hydrochloride IUPAC Name: 2-pyrrolidin-1-ylethyl 2-(2,5-dimethylphenyl)-2-hydroxy-2-phenylacetate hydrochloride Traditional Name: 2-(2,5-dimethylphenyl)-2-hydroxy-2-phenyl-acetic acid 2-pyrrolidinoethyl ester hydrochloride Formula: C22H28ClNO3 MolecularWeight: 389.91562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C2=CC=CC=C2)(C(=O)OCCN3CCCC3)O.Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(C2=CC=CC=C2)(C(=O)OCCN3CCCC3)O.Cl

InChI

InChI=1S/C22H27NO3.ClH/c1-17-10-11-18(2)20(16-17)22(25,19-8-4-3-5-9-19)21(24)26-15-14-23-12-6-7-13-23;/h3-5,8-11,16,25H,6-7,12-15H2,1-2H3;1H