1-[(5-chloranylthiophen-2-yl)-(4-propan-2-ylphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-chloranylthiophen-2-yl)-(4-propan-2-ylphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-chloro-2-thienyl)-(4-isopropylphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-chloro-2-thiophenyl)-(4-propan-2-ylphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-chlorothiophen-2-yl)-(4-propan-2-ylphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-chloro-2-thienyl)-p-cumenyl-methyl]proline Formula: C19H22ClNO2S MolecularWeight: 363.90148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C2=CC=C(S2)Cl)N3CCCC3C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C2=CC=C(S2)Cl)N3CCCC3C(=O)O

InChI

InChI=1S/C19H22ClNO2S/c1-12(2)13-5-7-14(8-6-13)18(16-9-10-17(20)24-16)21-11-3-4-15(21)19(22)23/h5-10,12,15,18H,3-4,11H2,1-2H3,(H,22,23)