[(1R,5S)-5-(acetyloxymethyl)-9-methylidene-3-(phenylmethyl)-3-azabicyclo[3.3.1]nonan-1-yl]methyl ethanoate

Systemtic Name: [(1R,5S)-5-(acetyloxymethyl)-9-methylidene-3-(phenylmethyl)-3-azabicyclo[3.3.1]nonan-1-yl]methyl ethanoate Openeye Name: [(1R,5S)-5-(acetoxymethyl)-3-benzyl-9-methylene-3-azabicyclo[3.3.1]nonan-1-yl]methyl acetate CAS Name: acetic acid [(1R,5S)-5-(acetyloxymethyl)-9-methylene-3-(phenylmethyl)-3-azabicyclo[3.3.1]nonan-1-yl]methyl ester IUPAC Name: [(1R,5S)-5-(acetyloxymethyl)-3-benzyl-9-methylidene-3-azabicyclo[3.3.1]nonan-1-yl]methyl acetate Traditional Name: acetic acid [(1R,5S)-5-(acetoxymethyl)-3-benzyl-9-methylene-3-azabicyclo[3.3.1]nonan-1-yl]methyl ester Formula: C22H29NO4 MolecularWeight: 371.46996

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC12CCCC(C1=C)(CN(C2)CC3=CC=CC=C3)COC(=O)C

Isomeric SMILES

CC(=O)OC[C@]12CCC[C@](C1=C)(CN(C2)CC3=CC=CC=C3)COC(=O)C

InChI

InChI=1S/C22H29NO4/c1-17-21(15-26-18(2)24)10-7-11-22(17,16-27-19(3)25)14-23(13-21)12-20-8-5-4-6-9-20/h4-6,8-9H,1,7,10-16H2,2-3H3/t21-,22+