2-[bis[2-[carboxymethyl-(2-heptoxy-2-oxidanylidene-ethyl)amino]ethyl]amino]ethanoic acid

Systemtic Name: 2-[bis[2-[carboxymethyl-(2-heptoxy-2-oxidanylidene-ethyl)amino]ethyl]amino]ethanoic acid Openeye Name: 2-[bis[2-[carboxymethyl-(2-heptoxy-2-oxo-ethyl)amino]ethyl]amino]acetic acid CAS Name: 2-[bis[2-[carboxymethyl-(2-heptoxy-2-oxoethyl)amino]ethyl]amino]acetic acid IUPAC Name: 2-[bis[2-[carboxymethyl-(2-heptoxy-2-oxoethyl)amino]ethyl]amino]acetic acid Traditional Name: 2-[bis[2-[carboxymethyl-(2-heptoxy-2-keto-ethyl)amino]ethyl]amino]acetic acid Formula: C28H51N3O10 MolecularWeight: 589.71864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)CN(CCN(CCN(CC(=O)O)CC(=O)OCCCCCCC)CC(=O)O)CC(=O)O

Isomeric SMILES

CCCCCCCOC(=O)CN(CCN(CCN(CC(=O)O)CC(=O)OCCCCCCC)CC(=O)O)CC(=O)O

InChI

InChI=1S/C28H51N3O10/c1-3-5-7-9-11-17-40-27(38)22-30(20-25(34)35)15-13-29(19-24(32)33)14-16-31(21-26(36)37)23-28(39)41-18-12-10-8-6-4-2/h3-23H2,1-2H3,(H,32,33)(H,34,35)(H,36,37)