1-[thiophen-2-yl-(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[thiophen-2-yl-(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-thienyl-(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[thiophen-2-yl-(2,4,5-trimethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[thiophen-2-yl-(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[asaryl(2-thienyl)methyl]proline Formula: C19H23NO5S MolecularWeight: 377.45462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(C2=CC=CS2)N3CCCC3C(=O)O)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(C2=CC=CS2)N3CCCC3C(=O)O)OC)OC

InChI

InChI=1S/C19H23NO5S/c1-23-14-11-16(25-3)15(24-2)10-12(14)18(17-7-5-9-26-17)20-8-4-6-13(20)19(21)22/h5,7,9-11,13,18H,4,6,8H2,1-3H3,(H,21,22)