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

Systemtic Name: 2-[2-[2-[[2-[bis(carboxymethyl)amino]-2-oxidanylidene-ethyl]-(2-tetradecanoyloxyethyl)amino]ethyl-(2-tetradecanoyloxyethyl)amino]ethanoyl-(carboxymethyl)amino]ethanoic acid Openeye Name: 2-[[2-[2-[[2-[bis(carboxymethyl)amino]-2-oxo-ethyl]-(2-tetradecanoyloxyethyl)amino]ethyl-(2-tetradecanoyloxyethyl)amino]acetyl]-(carboxymethyl)amino]acetic acid CAS Name: 2-[[2-[2-[[2-[bis(carboxymethyl)amino]-2-oxoethyl]-[2-(1-oxotetradecoxy)ethyl]amino]ethyl-[2-(1-oxotetradecoxy)ethyl]amino]-1-oxoethyl]-(carboxymethyl)amino]acetic acid IUPAC Name: 2-[[2-[2-[[2-[bis(carboxymethyl)amino]-2-oxoethyl]-(2-tetradecanoyloxyethyl)amino]ethyl-(2-tetradecanoyloxyethyl)amino]acetyl]-(carboxymethyl)amino]acetic acid Traditional Name: 2-[[2-[2-[[2-[bis(carboxymethyl)amino]-2-keto-ethyl]-(2-tetradecanoyloxyethyl)amino]ethyl-(2-tetradecanoyloxyethyl)amino]acetyl]-(carboxymethyl)amino]acetic acid Formula: C46H82N4O14 MolecularWeight: 915.16168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OCCN(CCN(CCOC(=O)CCCCCCCCCCCCC)CC(=O)N(CC(=O)O)CC(=O)O)CC(=O)N(CC(=O)O)CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OCCN(CCN(CCOC(=O)CCCCCCCCCCCCC)CC(=O)N(CC(=O)O)CC(=O)O)CC(=O)N(CC(=O)O)CC(=O)O

InChI

InChI=1S/C46H82N4O14/c1-3-5-7-9-11-13-15-17-19-21-23-25-45(61)63-31-29-47(33-39(51)49(35-41(53)54)36-42(55)56)27-28-48(34-40(52)50(37-43(57)58)38-44(59)60)30-32-64-46(62)26-24-22-20-18-16-14-12-10-8-6-4-2/h3-38H2,1-2H3,(H,53,54)(H,55,56)(H,57,58)(H,59,60)