ethyl (1R,4S)-7-(phenylmethyl)-7-azabicyclo[2.2.1]hept-2-ene-3-carboxylate

Systemtic Name: ethyl (1R,4S)-7-(phenylmethyl)-7-azabicyclo[2.2.1]hept-2-ene-3-carboxylate Openeye Name: ethyl (1R,4S)-7-benzyl-7-azabicyclo[2.2.1]hept-2-ene-3-carboxylate CAS Name: (1R,4S)-7-(phenylmethyl)-7-azabicyclo[2.2.1]hept-2-ene-3-carboxylic acid ethyl ester IUPAC Name: ethyl (1R,4S)-7-benzyl-7-azabicyclo[2.2.1]hept-2-ene-3-carboxylate Traditional Name: (1R,4S)-7-benzyl-7-azabicyclo[2.2.1]hept-2-ene-3-carboxylic acid ethyl ester Formula: C16H19NO2 MolecularWeight: 257.32756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2CCC1N2CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C[C@H]2CC[C@@H]1N2CC3=CC=CC=C3

InChI

InChI=1S/C16H19NO2/c1-2-19-16(18)14-10-13-8-9-15(14)17(13)11-12-6-4-3-5-7-12/h3-7,10,13,15H,2,8-9,11H2,1H3/t13-,15+/m1/s1