1-azabicyclo[2.2.2]octan-2-yl 2-oxidanyl-2,2-diphenyl-ethanoate; chloranylmethane

Systemtic Name: 1-azabicyclo[2.2.2]octan-2-yl 2-oxidanyl-2,2-diphenyl-ethanoate; chloranylmethane Openeye Name: chloromethane; quinuclidin-2-yl 2-hydroxy-2,2-diphenyl-acetate CAS Name: chloromethane; 2-hydroxy-2,2-diphenylacetic acid 1-azabicyclo[2.2.2]octan-2-yl ester IUPAC Name: 1-azabicyclo[2.2.2]octan-2-yl 2-hydroxy-2,2-diphenylacetate; chloromethane Traditional Name: chloromethane; 2-hydroxy-2,2-diphenyl-acetic acid quinuclidin-2-yl ester Formula: C22H26ClNO3 MolecularWeight: 387.89974

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Descriptors Computed from Structure

Canonical SMILES:

CCl.C1CN2CCC1CC2OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

Isomeric SMILES

CCl.C1CN2CCC1CC2OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

InChI

InChI=1S/C21H23NO3.CH3Cl/c23-20(25-19-15-16-11-13-22(19)14-12-16)21(24,17-7-3-1-4-8-17)18-9-5-2-6-10-18;1-2/h1-10,16,19,24H,11-15H2;1H3