2-[bis[2-(octadecanoylamino)ethyl]amino]ethanoic acid hydrochloride

Systemtic Name: 2-[bis[2-(octadecanoylamino)ethyl]amino]ethanoic acid hydrochloride Openeye Name: 2-[bis[2-(octadecanoylamino)ethyl]amino]acetic acid hydrochloride CAS Name: 2-[bis[2-(1-oxooctadecylamino)ethyl]amino]acetic acid hydrochloride IUPAC Name: 2-[bis[2-(octadecanoylamino)ethyl]amino]acetic acid hydrochloride Traditional Name: 2-[bis(2-stearamidoethyl)amino]acetic acid hydrochloride Formula: C42H84ClN3O4 MolecularWeight: 730.58706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCCN(CCNC(=O)CCCCCCCCCCCCCCCCC)CC(=O)O.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCCN(CCNC(=O)CCCCCCCCCCCCCCCCC)CC(=O)O.Cl

InChI

InChI=1S/C42H83N3O4.ClH/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(46)43-35-37-45(39-42(48)49)38-36-44-41(47)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h3-39H2,1-2H3,(H,43,46)(H,44,47)(H,48,49);1H