1-[(3-phenoxyphenyl)-thiophen-3-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-phenoxyphenyl)-thiophen-3-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-phenoxyphenyl)-(3-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-phenoxyphenyl)-(3-thiophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-phenoxyphenyl)-thiophen-3-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3-phenoxyphenyl)-(3-thienyl)methyl]proline Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CSC=C4)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CSC=C4)C(=O)O

InChI

InChI=1S/C22H21NO3S/c24-22(25)20-10-5-12-23(20)21(17-11-13-27-15-17)16-6-4-9-19(14-16)26-18-7-2-1-3-8-18/h1-4,6-9,11,13-15,20-21H,5,10,12H2,(H,24,25)