3-(4-tert-butylphenyl)-1-(2-methoxyethanoyl)-5-(2-phenylethenyl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-(4-tert-butylphenyl)-1-(2-methoxyethanoyl)-5-(2-phenylethenyl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-tert-butylphenyl)-1-(2-methoxyacetyl)-5-styryl-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(4-tert-butylphenyl)-1-(2-methoxy-1-oxoethyl)-4-[oxo(thiophen-2-yl)methyl]-5-(2-phenylethenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(4-tert-butylphenyl)-1-(2-methoxyacetyl)-5-(2-phenylethenyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(4-tert-butylphenyl)-1-(2-methoxyacetyl)-5-styryl-4-(2-thenoyl)proline Formula: C31H33NO5S MolecularWeight: 531.66242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2C(C(N(C2C(=O)O)C(=O)COC)C=CC3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2C(C(N(C2C(=O)O)C(=O)COC)C=CC3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C31H33NO5S/c1-31(2,3)22-15-13-21(14-16-22)26-27(29(34)24-11-8-18-38-24)23(17-12-20-9-6-5-7-10-20)32(25(33)19-37-4)28(26)30(35)36/h5-18,23,26-28H,19H2,1-4H3,(H,35,36)