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

Systemtic Name: bromanylmethane; (1-methylpiperidin-3-yl) 2-oxidanyl-2,2-diphenyl-ethanoate Openeye Name: bromomethane; (1-methyl-3-piperidyl) 2-hydroxy-2,2-diphenyl-acetate CAS Name: bromomethane; 2-hydroxy-2,2-diphenylacetic acid (1-methyl-3-piperidinyl) ester IUPAC Name: bromomethane; (1-methylpiperidin-3-yl) 2-hydroxy-2,2-diphenylacetate Traditional Name: bromomethane; 2-hydroxy-2,2-diphenyl-acetic acid (1-methyl-3-piperidyl) ester Formula: C21H26BrNO3 MolecularWeight: 420.34004

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O.CBr

Isomeric SMILES

CN1CCCC(C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O.CBr

InChI

InChI=1S/C20H23NO3.CH3Br/c1-21-14-8-13-18(15-21)24-19(22)20(23,16-9-4-2-5-10-16)17-11-6-3-7-12-17;1-2/h2-7,9-12,18,23H,8,13-15H2,1H3;1H3