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

Systemtic Name: 4-(3-chlorophenyl)carbonyl-1-(2-methoxyethanoyl)-2-methyl-5-(2-phenylethenyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(3-chlorobenzoyl)-1-(2-methoxyacetyl)-2-methyl-5-styryl-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 4-[(3-chlorophenyl)-oxomethyl]-1-(2-methoxy-1-oxoethyl)-2-methyl-5-(2-phenylethenyl)-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(3-chlorobenzoyl)-1-(2-methoxyacetyl)-2-methyl-5-(2-phenylethenyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-(3-chlorobenzoyl)-1-(2-methoxyacetyl)-2-methyl-5-styryl-3-(2-thienyl)proline Formula: C28H26ClNO5S MolecularWeight: 524.02774

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C(N1C(=O)COC)C=CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)Cl)C4=CC=CS4)C(=O)O

Isomeric SMILES

CC1(C(C(C(N1C(=O)COC)C=CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)Cl)C4=CC=CS4)C(=O)O

InChI

InChI=1S/C28H26ClNO5S/c1-28(27(33)34)25(22-12-7-15-36-22)24(26(32)19-10-6-11-20(29)16-19)21(30(28)23(31)17-35-2)14-13-18-8-4-3-5-9-18/h3-16,21,24-25H,17H2,1-2H3,(H,33,34)