3-[2-(2-carboxyoxypyrrolidin-1-yl)-1-(2-methylphenoxy)-2-oxidanylidene-ethoxy]-2-oxidanylidene-3-pyrrolidin-1-yl-propanoic acid

Systemtic Name: 3-[2-(2-carboxyoxypyrrolidin-1-yl)-1-(2-methylphenoxy)-2-oxidanylidene-ethoxy]-2-oxidanylidene-3-pyrrolidin-1-yl-propanoic acid Openeye Name: 3-[2-(2-carboxyoxypyrrolidin-1-yl)-1-(2-methylphenoxy)-2-oxo-ethoxy]-2-oxo-3-pyrrolidin-1-yl-propanoic acid CAS Name: 3-[2-(2-carboxyoxy-1-pyrrolidinyl)-1-(2-methylphenoxy)-2-oxoethoxy]-2-oxo-3-(1-pyrrolidinyl)propanoic acid IUPAC Name: 3-[2-(2-carboxyoxypyrrolidin-1-yl)-1-(2-methylphenoxy)-2-oxoethoxy]-2-oxo-3-pyrrolidin-1-ylpropanoic acid Traditional Name: 3-[2-(2-carboxyoxypyrrolidino)-2-keto-1-(2-methylphenoxy)ethoxy]-2-keto-3-pyrrolidino-propionic acid Formula: C21H26N2O9 MolecularWeight: 450.43914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(C(=O)N2CCCC2OC(=O)O)OC(C(=O)C(=O)O)N3CCCC3

Isomeric SMILES

CC1=CC=CC=C1OC(C(=O)N2CCCC2OC(=O)O)OC(C(=O)C(=O)O)N3CCCC3

InChI

InChI=1S/C21H26N2O9/c1-13-7-2-3-8-14(13)30-20(17(25)23-12-6-9-15(23)31-21(28)29)32-18(16(24)19(26)27)22-10-4-5-11-22/h2-3,7-8,15,18,20H,4-6,9-12H2,1H3,(H,26,27)(H,28,29)