4-(5-chloranylthiophen-2-yl)carbonyl-1-cyclohexylcarbonyl-3-(3-methoxyphenyl)-5-(2-phenylethenyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(5-chloranylthiophen-2-yl)carbonyl-1-cyclohexylcarbonyl-3-(3-methoxyphenyl)-5-(2-phenylethenyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclohexanecarbonyl)-3-(3-methoxyphenyl)-5-styryl-pyrrolidine-2-carboxylic acid CAS Name: 4-[(5-chloro-2-thiophenyl)-oxomethyl]-1-[cyclohexyl(oxo)methyl]-3-(3-methoxyphenyl)-5-(2-phenylethenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclohexanecarbonyl)-3-(3-methoxyphenyl)-5-(2-phenylethenyl)pyrrolidine-2-carboxylic acid Traditional Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclohexanecarbonyl)-3-(3-methoxyphenyl)-5-styryl-proline Formula: C32H32ClNO5S MolecularWeight: 578.11818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C(C(N(C2C(=O)O)C(=O)C3CCCCC3)C=CC4=CC=CC=C4)C(=O)C5=CC=C(S5)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C2C(C(N(C2C(=O)O)C(=O)C3CCCCC3)C=CC4=CC=CC=C4)C(=O)C5=CC=C(S5)Cl

InChI

InChI=1S/C32H32ClNO5S/c1-39-23-14-8-13-22(19-23)27-28(30(35)25-17-18-26(33)40-25)24(16-15-20-9-4-2-5-10-20)34(29(27)32(37)38)31(36)21-11-6-3-7-12-21/h2,4-5,8-10,13-19,21,24,27-29H,3,6-7,11-12H2,1H3,(H,37,38)