(phenylmethyl) 5-(hydroxymethyl)-1,4-dimethyl-7-azabicyclo[2.2.1]hept-2-ene-7-carboxylate

Systemtic Name: (phenylmethyl) 5-(hydroxymethyl)-1,4-dimethyl-7-azabicyclo[2.2.1]hept-2-ene-7-carboxylate Openeye Name: benzyl 5-(hydroxymethyl)-1,4-dimethyl-7-azabicyclo[2.2.1]hept-2-ene-7-carboxylate CAS Name: 5-(hydroxymethyl)-1,4-dimethyl-7-azabicyclo[2.2.1]hept-2-ene-7-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-(hydroxymethyl)-1,4-dimethyl-7-azabicyclo[2.2.1]hept-2-ene-7-carboxylate Traditional Name: 1,4-dimethyl-5-methylol-7-azabicyclo[2.2.1]hept-2-ene-7-carboxylic acid benzyl ester Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC(C(N1C(=O)OCC3=CC=CC=C3)(C=C2)C)CO

Isomeric SMILES

CC12CC(C(N1C(=O)OCC3=CC=CC=C3)(C=C2)C)CO

InChI

InChI=1S/C17H21NO3/c1-16-8-9-17(2,14(10-16)11-19)18(16)15(20)21-12-13-6-4-3-5-7-13/h3-9,14,19H,10-12H2,1-2H3