1-[thiophen-3-yl-(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[thiophen-3-yl-(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[3-thienyl-(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[3-thiophenyl-(2,4,5-trimethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[thiophen-3-yl-(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[asaryl(3-thienyl)methyl]proline Formula: C19H23NO5S MolecularWeight: 377.45462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23NO5S/c1-23-15-10-17(25-3)16(24-2)9-13(15)18(12-6-8-26-11-12)20-7-4-5-14(20)19(21)22/h6,8-11,14,18H,4-5,7H2,1-3H3,(H,21,22)