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

Systemtic Name: 1-[(4-methoxyphenyl)-(4-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-methoxyphenyl)-(4-methyl-2-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(4-methoxyphenyl)-(4-methyl-2-thiophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-methoxyphenyl)-(4-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-methoxyphenyl)-(4-methyl-2-thienyl)methyl]proline Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO3S/c1-12-10-16(23-11-12)17(13-5-7-14(22-2)8-6-13)19-9-3-4-15(19)18(20)21/h5-8,10-11,15,17H,3-4,9H2,1-2H3,(H,20,21)