(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-acetyloxy-2-cyano-2-phenyl-ethanoate

Systemtic Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-acetyloxy-2-cyano-2-phenyl-ethanoate Openeye Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-acetoxy-2-cyano-2-phenyl-acetate CAS Name: 2-acetyloxy-2-cyano-2-phenylacetic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-acetyloxy-2-cyano-2-phenylacetate Traditional Name: 2-acetoxy-2-cyano-2-phenyl-acetic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester Formula: C19H22N2O4 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C#N)(C1=CC=CC=C1)C(=O)OC2CC3CCC(C2)N3C

Isomeric SMILES

CC(=O)OC(C#N)(C1=CC=CC=C1)C(=O)OC2CC3CCC(C2)N3C

InChI

InChI=1S/C19H22N2O4/c1-13(22)25-19(12-20,14-6-4-3-5-7-14)18(23)24-17-10-15-8-9-16(11-17)21(15)2/h3-7,15-17H,8-11H2,1-2H3