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

Systemtic Name: 1-[(2-methoxyphenyl)-(4-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2-methoxyphenyl)-(4-methyl-2-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-methoxyphenyl)-(4-methyl-2-thiophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-methoxyphenyl)-(4-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2-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=CC=C2OC)N3CCCC3C(=O)O

Isomeric SMILES

CC1=CSC(=C1)C(C2=CC=CC=C2OC)N3CCCC3C(=O)O

InChI

InChI=1S/C18H21NO3S/c1-12-10-16(23-11-12)17(13-6-3-4-8-15(13)22-2)19-9-5-7-14(19)18(20)21/h3-4,6,8,10-11,14,17H,5,7,9H2,1-2H3,(H,20,21)