1-[(5-methylthiophen-2-yl)-naphthalen-2-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-methylthiophen-2-yl)-naphthalen-2-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-methyl-2-thienyl)-(2-naphthyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-methyl-2-thiophenyl)-(2-naphthalenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-methylthiophen-2-yl)-naphthalen-2-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-methyl-2-thienyl)-(2-naphthyl)methyl]proline Formula: C21H21NO2S MolecularWeight: 351.46194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C2=CC3=CC=CC=C3C=C2)N4CCCC4C(=O)O

Isomeric SMILES

CC1=CC=C(S1)C(C2=CC3=CC=CC=C3C=C2)N4CCCC4C(=O)O

InChI

InChI=1S/C21H21NO2S/c1-14-8-11-19(25-14)20(22-12-4-7-18(22)21(23)24)17-10-9-15-5-2-3-6-16(15)13-17/h2-3,5-6,8-11,13,18,20H,4,7,12H2,1H3,(H,23,24)