4-(3-chlorophenyl)carbonyl-1-(3-fluorophenyl)carbonyl-5-(2-phenylethenyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)carbonyl-1-(3-fluorophenyl)carbonyl-5-(2-phenylethenyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(3-chlorobenzoyl)-1-(3-fluorobenzoyl)-5-styryl-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 4-[(3-chlorophenyl)-oxomethyl]-1-[(3-fluorophenyl)-oxomethyl]-5-(2-phenylethenyl)-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(3-chlorobenzoyl)-1-(3-fluorobenzoyl)-5-(2-phenylethenyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-(3-chlorobenzoyl)-1-(3-fluorobenzoyl)-5-styryl-3-(2-thienyl)proline Formula: C31H23ClFNO4S MolecularWeight: 560.035023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC2C(C(C(N2C(=O)C3=CC(=CC=C3)F)C(=O)O)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)C=CC2C(C(C(N2C(=O)C3=CC(=CC=C3)F)C(=O)O)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C31H23ClFNO4S/c32-22-11-4-9-20(17-22)29(35)26-24(15-14-19-7-2-1-3-8-19)34(30(36)21-10-5-12-23(33)18-21)28(31(37)38)27(26)25-13-6-16-39-25/h1-18,24,26-28H,(H,37,38)