4-(1,3-benzodioxol-5-yl)pyrrolidine-3-carboxylic acid

Systemtic Name: 4-(1,3-benzodioxol-5-yl)pyrrolidine-3-carboxylic acid Openeye Name: 4-(1,3-benzodioxol-5-yl)pyrrolidine-3-carboxylic acid CAS Name: 4-(1,3-benzodioxol-5-yl)-3-pyrrolidinecarboxylic acid IUPAC Name: 4-(1,3-benzodioxol-5-yl)pyrrolidine-3-carboxylic acid Traditional Name: 4-(1,3-benzodioxol-5-yl)pyrrolidine-3-carboxylic acid Formula: C12H13NO4 MolecularWeight: 235.23592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1)C(=O)O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1C(C(CN1)C(=O)O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C12H13NO4/c14-12(15)9-5-13-4-8(9)7-1-2-10-11(3-7)17-6-16-10/h1-3,8-9,13H,4-6H2,(H,14,15)