bromanylethane; 2-piperidin-1-ylethyl 2-oxidanyl-2,2-diphenyl-ethanoate

Systemtic Name: bromanylethane; 2-piperidin-1-ylethyl 2-oxidanyl-2,2-diphenyl-ethanoate Openeye Name: bromoethane; 2-(1-piperidyl)ethyl 2-hydroxy-2,2-diphenyl-acetate CAS Name: bromoethane; 2-hydroxy-2,2-diphenylacetic acid 2-(1-piperidinyl)ethyl ester IUPAC Name: bromoethane; 2-piperidin-1-ylethyl 2-hydroxy-2,2-diphenylacetate Traditional Name: bromoethane; 2-hydroxy-2,2-diphenyl-acetic acid 2-piperidinoethyl ester Formula: C23H30BrNO3 MolecularWeight: 448.3932

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Descriptors Computed from Structure

Canonical SMILES:

CCBr.C1CCN(CC1)CCOC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O

Isomeric SMILES

CCBr.C1CCN(CC1)CCOC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O

InChI

InChI=1S/C21H25NO3.C2H5Br/c23-20(25-17-16-22-14-8-3-9-15-22)21(24,18-10-4-1-5-11-18)19-12-6-2-7-13-19;1-2-3/h1-2,4-7,10-13,24H,3,8-9,14-17H2;2H2,1H3