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

Systemtic Name: 1-[(2,4-dimethoxyphenyl)-(4-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2,4-dimethoxyphenyl)-(4-methyl-2-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,4-dimethoxyphenyl)-(4-methyl-2-thiophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,4-dimethoxyphenyl)-(4-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2,4-dimethoxyphenyl)-(4-methyl-2-thienyl)methyl]proline Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C(C2=C(C=C(C=C2)OC)OC)N3CCCC3C(=O)O

Isomeric SMILES

CC1=CSC(=C1)C(C2=C(C=C(C=C2)OC)OC)N3CCCC3C(=O)O

InChI

InChI=1S/C19H23NO4S/c1-12-9-17(25-11-12)18(20-8-4-5-15(20)19(21)22)14-7-6-13(23-2)10-16(14)24-3/h6-7,9-11,15,18H,4-5,8H2,1-3H3,(H,21,22)