1-[(4-methylthiophen-2-yl)-(2-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(4-methylthiophen-2-yl)-(2-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2-benzyloxyphenyl)-(4-methyl-2-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(4-methyl-2-thiophenyl)-(2-phenylmethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-methylthiophen-2-yl)-(2-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2-benzoxyphenyl)-(4-methyl-2-thienyl)methyl]proline Formula: C24H25NO3S MolecularWeight: 407.5252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C(C2=CC=CC=C2OCC3=CC=CC=C3)N4CCCC4C(=O)O

Isomeric SMILES

CC1=CSC(=C1)C(C2=CC=CC=C2OCC3=CC=CC=C3)N4CCCC4C(=O)O

InChI

InChI=1S/C24H25NO3S/c1-17-14-22(29-16-17)23(25-13-7-11-20(25)24(26)27)19-10-5-6-12-21(19)28-15-18-8-3-2-4-9-18/h2-6,8-10,12,14,16,20,23H,7,11,13,15H2,1H3,(H,26,27)