(phenylmethyl) (1S,2S,5S)-2-ethoxy-6-methyl-3-methylidene-9-azabicyclo[3.3.1]non-6-ene-9-carboxylate

Systemtic Name: (phenylmethyl) (1S,2S,5S)-2-ethoxy-6-methyl-3-methylidene-9-azabicyclo[3.3.1]non-6-ene-9-carboxylate Openeye Name: benzyl (1S,2S,5S)-2-ethoxy-6-methyl-3-methylene-9-azabicyclo[3.3.1]non-6-ene-9-carboxylate CAS Name: (1S,2S,5S)-2-ethoxy-6-methyl-3-methylene-9-azabicyclo[3.3.1]non-6-ene-9-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (1S,2S,5S)-2-ethoxy-6-methyl-3-methylidene-9-azabicyclo[3.3.1]non-6-ene-9-carboxylate Traditional Name: (1S,2S,5S)-2-ethoxy-6-methyl-3-methylene-9-azabicyclo[3.3.1]non-6-ene-9-carboxylic acid benzyl ester Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C2CC=C(C(N2C(=O)OCC3=CC=CC=C3)CC1=C)C

Isomeric SMILES

CCO[C@@H]1[C@@H]2CC=C([C@@H](N2C(=O)OCC3=CC=CC=C3)CC1=C)C

InChI

InChI=1S/C20H25NO3/c1-4-23-19-15(3)12-18-14(2)10-11-17(19)21(18)20(22)24-13-16-8-6-5-7-9-16/h5-10,17-19H,3-4,11-13H2,1-2H3/t17-,18-,19-/m0/s1