(2R,3R)-3-azanyl-2-(3,4-dimethoxyphenyl)bicyclo[2.2.1]hept-5-ene-3-carboxylic acid

Systemtic Name: (2R,3R)-3-azanyl-2-(3,4-dimethoxyphenyl)bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Openeye Name: (2R,3R)-3-amino-2-(3,4-dimethoxyphenyl)bicyclo[2.2.1]hept-5-ene-3-carboxylic acid CAS Name: (2R,3R)-3-amino-2-(3,4-dimethoxyphenyl)-3-bicyclo[2.2.1]hept-5-enecarboxylic acid IUPAC Name: (2R,3R)-3-amino-2-(3,4-dimethoxyphenyl)bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Traditional Name: (2R,3R)-3-amino-2-(3,4-dimethoxyphenyl)bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C3CC(C2(C(=O)O)N)C=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H]2C3CC([C@@]2(C(=O)O)N)C=C3)OC

InChI

InChI=1S/C16H19NO4/c1-20-12-6-4-10(8-13(12)21-2)14-9-3-5-11(7-9)16(14,17)15(18)19/h3-6,8-9,11,14H,7,17H2,1-2H3,(H,18,19)/t9?,11?,14-,16-/m1/s1