2-azanyl-2-(4-azanylbutyl)-3-oxidanylidene-octadecanoic acid

Systemtic Name: 2-azanyl-2-(4-azanylbutyl)-3-oxidanylidene-octadecanoic acid Openeye Name: 2-amino-2-(4-aminobutyl)-3-oxo-octadecanoic acid CAS Name: 2-amino-2-(4-aminobutyl)-3-oxooctadecanoic acid IUPAC Name: 2-amino-2-(4-aminobutyl)-3-oxooctadecanoic acid Traditional Name: 2-amino-2-(4-aminobutyl)-3-keto-stearic acid Formula: C22H44N2O3 MolecularWeight: 384.59636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(CCCCN)(C(=O)O)N

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(CCCCN)(C(=O)O)N

InChI

InChI=1S/C22H44N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20(25)22(24,21(26)27)18-15-16-19-23/h2-19,23-24H2,1H3,(H,26,27)