bromanylmethane; (1-ethylpiperidin-3-yl) 2-oxidanyl-2,2-diphenyl-ethanoate

Systemtic Name: bromanylmethane; (1-ethylpiperidin-3-yl) 2-oxidanyl-2,2-diphenyl-ethanoate Openeye Name: bromomethane; (1-ethyl-3-piperidyl) 2-hydroxy-2,2-diphenyl-acetate CAS Name: bromomethane; 2-hydroxy-2,2-diphenylacetic acid (1-ethyl-3-piperidinyl) ester IUPAC Name: bromomethane; (1-ethylpiperidin-3-yl) 2-hydroxy-2,2-diphenylacetate Traditional Name: bromomethane; 2-hydroxy-2,2-diphenyl-acetic acid (1-ethyl-3-piperidyl) ester Formula: C22H28BrNO3 MolecularWeight: 434.36662

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O.CBr

Isomeric SMILES

CCN1CCCC(C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O.CBr

InChI

InChI=1S/C21H25NO3.CH3Br/c1-2-22-15-9-14-19(16-22)25-20(23)21(24,17-10-5-3-6-11-17)18-12-7-4-8-13-18;1-2/h3-8,10-13,19,24H,2,9,14-16H2,1H3;1H3