5-(1,3-benzodioxol-5-yl)-1-cyclohexylcarbonyl-4-(2,5-dimethylfuran-3-yl)carbonyl-3-(4-methoxyphenyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-1-cyclohexylcarbonyl-4-(2,5-dimethylfuran-3-yl)carbonyl-3-(4-methoxyphenyl)pyrrolidine-2-carboxylic acid Openeye Name: 5-(1,3-benzodioxol-5-yl)-1-(cyclohexanecarbonyl)-4-(2,5-dimethylfuran-3-carbonyl)-3-(4-methoxyphenyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(1,3-benzodioxol-5-yl)-1-[cyclohexyl(oxo)methyl]-4-[(2,5-dimethyl-3-furanyl)-oxomethyl]-3-(4-methoxyphenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(1,3-benzodioxol-5-yl)-1-(cyclohexanecarbonyl)-4-(2,5-dimethylfuran-3-carbonyl)-3-(4-methoxyphenyl)pyrrolidine-2-carboxylic acid Traditional Name: 5-(1,3-benzodioxol-5-yl)-1-(cyclohexanecarbonyl)-4-(2,5-dimethyl-3-furoyl)-3-(4-methoxyphenyl)proline Formula: C33H35NO8 MolecularWeight: 573.6329

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)C2C(C(N(C2C3=CC4=C(C=C3)OCO4)C(=O)C5CCCCC5)C(=O)O)C6=CC=C(C=C6)OC

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)C2C(C(N(C2C3=CC4=C(C=C3)OCO4)C(=O)C5CCCCC5)C(=O)O)C6=CC=C(C=C6)OC

InChI

InChI=1S/C33H35NO8/c1-18-15-24(19(2)42-18)31(35)28-27(20-9-12-23(39-3)13-10-20)30(33(37)38)34(32(36)21-7-5-4-6-8-21)29(28)22-11-14-25-26(16-22)41-17-40-25/h9-16,21,27-30H,4-8,17H2,1-3H3,(H,37,38)