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2-(4-azanylbutyl)-2-(octadecylamino)octadecanoic acid

2-(4-azanylbutyl)-2-(octadecylamino)octadecanoic acid

Systemtic Name:2-(4-azanylbutyl)-2-(octadecylamino)octadecanoic acid
Openeye Name:2-(4-aminobutyl)-2-(octadecylamino)octadecanoic acid
CAS Name:2-(4-aminobutyl)-2-(octadecylamino)octadecanoic acid
IUPAC Name:2-(4-aminobutyl)-2-(octadecylamino)octadecanoic acid
Traditional Name:2-(4-aminobutyl)-2-(stearylamino)stearic acid
Formula: C40H82N2O2
MolecularWeight: 623.09128
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(CCCCCCCCCCCCCCCC)(CCCCN)C(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(CCCCCCCCCCCCCCCC)(CCCCN)C(=O)O


InChI

InChI=1S/C40H82N2O2/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-34-38-42-40(39(43)44,36-32-33-37-41)35-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h42H,3-38,41H2,1-2H3,(H,43,44)


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