1-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]proline Formula: C14H16N2O5 MolecularWeight: 292.28724

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CC(=O)NC2=CC3=C(C=C2)OCO3)C(=O)O

Isomeric SMILES

C1CC(N(C1)CC(=O)NC2=CC3=C(C=C2)OCO3)C(=O)O

InChI

InChI=1S/C14H16N2O5/c17-13(7-16-5-1-2-10(16)14(18)19)15-9-3-4-11-12(6-9)21-8-20-11/h3-4,6,10H,1-2,5,7-8H2,(H,15,17)(H,18,19)