18-[2-azanylethyl-(18-oxidanidyl-18-oxidanylidene-octadecyl)amino]octadecanoate

Systemtic Name: 18-[2-azanylethyl-(18-oxidanidyl-18-oxidanylidene-octadecyl)amino]octadecanoate Openeye Name: 18-[2-aminoethyl-(18-oxido-18-oxo-octadecyl)amino]octadecanoate CAS Name: 18-[2-aminoethyl-(18-oxido-18-oxooctadecyl)amino]octadecanoate IUPAC Name: 18-[2-aminoethyl-(18-oxido-18-oxooctadecyl)amino]octadecanoate Traditional Name: 18-[2-aminoethyl-(18-keto-18-oxido-octadecyl)amino]stearate Formula: C38H74N2O4-2 MolecularWeight: 623.00516

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCCCCCC(=O)[O-])CCCCCCCCN(CCCCCCCCCCCCCCCCCC(=O)[O-])CCN

Isomeric SMILES

C(CCCCCCCCC(=O)[O-])CCCCCCCCN(CCCCCCCCCCCCCCCCCC(=O)[O-])CCN

InChI

InChI=1S/C38H76N2O4/c39-33-36-40(34-29-25-21-17-13-9-5-1-3-7-11-15-19-23-27-31-37(41)42)35-30-26-22-18-14-10-6-2-4-8-12-16-20-24-28-32-38(43)44/h1-36,39H2,(H,41,42)(H,43,44)/p-2