2-[2,2-bis(2-carboxylatobutanoyloxymethyl)butoxycarbonyl]butanoate

Systemtic Name: 2-[2,2-bis(2-carboxylatobutanoyloxymethyl)butoxycarbonyl]butanoate Openeye Name: 2-[2,2-bis(2-carboxylatobutanoyloxymethyl)butoxycarbonyl]butanoate CAS Name: 2-[2,2-bis[(2-carboxylato-1-oxobutoxy)methyl]butoxy-oxomethyl]butanoate IUPAC Name: 2-[2,2-bis(2-carboxylatobutanoyloxymethyl)butoxycarbonyl]butanoate Traditional Name: 2-[2,2-bis(2-carboxylatobutanoyloxymethyl)butoxycarbonyl]butyrate Formula: C21H29O12-3 MolecularWeight: 473.44776

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])C(=O)OCC(CC)(COC(=O)C(CC)C(=O)[O-])COC(=O)C(CC)C(=O)[O-]

Isomeric SMILES

CCC(C(=O)[O-])C(=O)OCC(CC)(COC(=O)C(CC)C(=O)[O-])COC(=O)C(CC)C(=O)[O-]

InChI

InChI=1S/C21H32O12/c1-5-12(15(22)23)18(28)31-9-21(8-4,10-32-19(29)13(6-2)16(24)25)11-33-20(30)14(7-3)17(26)27/h12-14H,5-11H2,1-4H3,(H,22,23)(H,24,25)(H,26,27)/p-3