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

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-1-cyclopropylcarbonyl-4-(2,5-dimethylfuran-3-yl)carbonyl-3-(4-methoxyphenyl)pyrrolidine-2-carboxylic acid Openeye Name: 5-(1,3-benzodioxol-5-yl)-1-(cyclopropanecarbonyl)-4-(2,5-dimethylfuran-3-carbonyl)-3-(4-methoxyphenyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(1,3-benzodioxol-5-yl)-1-[cyclopropyl(oxo)methyl]-4-[(2,5-dimethyl-3-furanyl)-oxomethyl]-3-(4-methoxyphenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(1,3-benzodioxol-5-yl)-1-(cyclopropanecarbonyl)-4-(2,5-dimethylfuran-3-carbonyl)-3-(4-methoxyphenyl)pyrrolidine-2-carboxylic acid Traditional Name: 5-(1,3-benzodioxol-5-yl)-1-(cyclopropanecarbonyl)-4-(2,5-dimethyl-3-furoyl)-3-(4-methoxyphenyl)proline Formula: C30H29NO8 MolecularWeight: 531.55316

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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)C5CC5)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)C5CC5)C(=O)O)C6=CC=C(C=C6)OC

InChI

InChI=1S/C30H29NO8/c1-15-12-21(16(2)39-15)28(32)25-24(17-6-9-20(36-3)10-7-17)27(30(34)35)31(29(33)18-4-5-18)26(25)19-8-11-22-23(13-19)38-14-37-22/h6-13,18,24-27H,4-5,14H2,1-3H3,(H,34,35)