3,4-bis(carboxymethyl)-3,4-bis(dibutylamino)hexanedioic acid

Systemtic Name: 3,4-bis(carboxymethyl)-3,4-bis(dibutylamino)hexanedioic acid Openeye Name: 3,4-bis(carboxymethyl)-3,4-bis(dibutylamino)hexanedioic acid CAS Name: 3,4-bis(carboxymethyl)-3,4-bis(dibutylamino)hexanedioic acid IUPAC Name: 3,4-bis(carboxymethyl)-3,4-bis(dibutylamino)hexanedioic acid Traditional Name: 3,4-bis(carboxymethyl)-3,4-bis(dibutylamino)adipic acid Formula: C26H48N2O8 MolecularWeight: 516.66792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(CC(=O)O)(CC(=O)O)C(CC(=O)O)(CC(=O)O)N(CCCC)CCCC

Isomeric SMILES

CCCCN(CCCC)C(CC(=O)O)(CC(=O)O)C(CC(=O)O)(CC(=O)O)N(CCCC)CCCC

InChI

InChI=1S/C26H48N2O8/c1-5-9-13-27(14-10-6-2)25(17-21(29)30,18-22(31)32)26(19-23(33)34,20-24(35)36)28(15-11-7-3)16-12-8-4/h5-20H2,1-4H3,(H,29,30)(H,31,32)(H,33,34)(H,35,36)