methyl (1R,2R,3S,4S)-3-benzamido-2-ethoxycarbonyloxy-bicyclo[2.2.1]hept-5-ene-3-carboxylate

Systemtic Name: methyl (1R,2R,3S,4S)-3-benzamido-2-ethoxycarbonyloxy-bicyclo[2.2.1]hept-5-ene-3-carboxylate Openeye Name: methyl (1R,2R,3S,4S)-3-benzamido-2-ethoxycarbonyloxy-bicyclo[2.2.1]hept-5-ene-3-carboxylate CAS Name: (1R,2R,3S,4S)-3-benzamido-2-ethoxycarbonyloxy-3-bicyclo[2.2.1]hept-5-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,2R,3S,4S)-3-benzamido-2-ethoxycarbonyloxybicyclo[2.2.1]hept-5-ene-3-carboxylate Traditional Name: (1R,2R,3S,4S)-3-benzamido-2-carbethoxyoxy-bicyclo[2.2.1]hept-5-ene-3-carboxylic acid methyl ester Formula: C19H21NO6 MolecularWeight: 359.37314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC1C2CC(C1(C(=O)OC)NC(=O)C3=CC=CC=C3)C=C2

Isomeric SMILES

CCOC(=O)O[C@@H]1[C@@H]2C[C@H]([C@]1(C(=O)OC)NC(=O)C3=CC=CC=C3)C=C2

InChI

InChI=1S/C19H21NO6/c1-3-25-18(23)26-15-13-9-10-14(11-13)19(15,17(22)24-2)20-16(21)12-7-5-4-6-8-12/h4-10,13-15H,3,11H2,1-2H3,(H,20,21)/t13-,14+,15+,19-/m0/s1