1-[(3,4-dimethoxyphenyl)-(furan-2-yl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3,4-dimethoxyphenyl)-(furan-2-yl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3,4-dimethoxyphenyl)-(2-furyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3,4-dimethoxyphenyl)-(2-furanyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3,4-dimethoxyphenyl)-(furan-2-yl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3,4-dimethoxyphenyl)-(2-furyl)methyl]proline Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2=CC=CO2)N3CCCC3C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C2=CC=CO2)N3CCCC3C(=O)O)OC

InChI

InChI=1S/C18H21NO5/c1-22-14-8-7-12(11-16(14)23-2)17(15-6-4-10-24-15)19-9-3-5-13(19)18(20)21/h4,6-8,10-11,13,17H,3,5,9H2,1-2H3,(H,20,21)