2-[2-[1,3-bis(oxidanylidene)-5-phenylmethoxycarbonyl-isoindol-2-yl]butanoyl]-1-phenylmethoxycarbonyl-pyrazolidine-3-carboxylic acid

Systemtic Name: 2-[2-[1,3-bis(oxidanylidene)-5-phenylmethoxycarbonyl-isoindol-2-yl]butanoyl]-1-phenylmethoxycarbonyl-pyrazolidine-3-carboxylic acid Openeye Name: 1-benzyloxycarbonyl-2-[2-(5-benzyloxycarbonyl-1,3-dioxo-isoindolin-2-yl)butanoyl]pyrazolidine-3-carboxylic acid CAS Name: 2-[2-(1,3-dioxo-5-phenylmethoxycarbonyl-2-isoindolyl)-1-oxobutyl]-1-phenylmethoxycarbonyl-3-pyrazolidinecarboxylic acid IUPAC Name: 2-[2-(1,3-dioxo-5-phenylmethoxycarbonylisoindol-2-yl)butanoyl]-1-phenylmethoxycarbonylpyrazolidine-3-carboxylic acid Traditional Name: 1-carbobenzoxy-2-[2-(5-carbobenzoxy-1,3-diketo-isoindolin-2-yl)butanoyl]pyrazolidine-3-carboxylic acid Formula: C32H29N3O9 MolecularWeight: 599.58736

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C(CCN1C(=O)OCC2=CC=CC=C2)C(=O)O)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CCC(C(=O)N1C(CCN1C(=O)OCC2=CC=CC=C2)C(=O)O)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C32H29N3O9/c1-2-25(29(38)35-26(30(39)40)15-16-33(35)32(42)44-19-21-11-7-4-8-12-21)34-27(36)23-14-13-22(17-24(23)28(34)37)31(41)43-18-20-9-5-3-6-10-20/h3-14,17,25-26H,2,15-16,18-19H2,1H3,(H,39,40)