1-[(5-bromanylthiophen-2-yl)-(4-phenylphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-bromanylthiophen-2-yl)-(4-phenylphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-bromo-2-thienyl)-(4-phenylphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-bromo-2-thiophenyl)-(4-phenylphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-bromothiophen-2-yl)-(4-phenylphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-bromo-2-thienyl)-(4-phenylphenyl)methyl]proline Formula: C22H20BrNO2S MolecularWeight: 442.3687

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC=C(S4)Br)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC=C(S4)Br)C(=O)O

InChI

InChI=1S/C22H20BrNO2S/c23-20-13-12-19(27-20)21(24-14-4-7-18(24)22(25)26)17-10-8-16(9-11-17)15-5-2-1-3-6-15/h1-3,5-6,8-13,18,21H,4,7,14H2,(H,25,26)