1-[(3-methoxy-4-phenylmethoxy-phenyl)-thiophen-2-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-methoxy-4-phenylmethoxy-phenyl)-thiophen-2-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)-(2-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)-thiophen-2-ylmethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)-thiophen-2-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3-methoxy-phenyl)-(2-thienyl)methyl]proline Formula: C24H25NO4S MolecularWeight: 423.5246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C2=CC=CS2)N3CCCC3C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(C2=CC=CS2)N3CCCC3C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C24H25NO4S/c1-28-21-15-18(11-12-20(21)29-16-17-7-3-2-4-8-17)23(22-10-6-14-30-22)25-13-5-9-19(25)24(26)27/h2-4,6-8,10-12,14-15,19,23H,5,9,13,16H2,1H3,(H,26,27)