(4-aminocarbonylphenyl)methyl (1S,4R)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate

Systemtic Name: (4-aminocarbonylphenyl)methyl (1S,4R)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate Openeye Name: (4-carbamoylphenyl)methyl (1S,4R)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate CAS Name: (1S,4R)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid (4-carbamoylphenyl)methyl ester IUPAC Name: (4-carbamoylphenyl)methyl (1S,4R)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate Traditional Name: (1S,4R)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid (4-carbamoylbenzyl) ester Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C=CC1N(O2)C(=O)OCC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1C[C@@H]2C=C[C@H]1N(O2)C(=O)OCC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C15H16N2O4/c16-14(18)11-3-1-10(2-4-11)9-20-15(19)17-12-5-7-13(21-17)8-6-12/h1-5,7,12-13H,6,8-9H2,(H2,16,18)/t12-,13+/m1/s1