(2S)-2,6-bis(azanyl)-7-oxidanylidene-octadecanoic acid

Systemtic Name: (2S)-2,6-bis(azanyl)-7-oxidanylidene-octadecanoic acid Openeye Name: (2S)-2,6-diamino-7-oxo-octadecanoic acid CAS Name: (2S)-2,6-diamino-7-oxooctadecanoic acid IUPAC Name: (2S)-2,6-diamino-7-oxooctadecanoic acid Traditional Name: (2S)-2,6-diamino-7-keto-stearic acid Formula: C18H36N2O3 MolecularWeight: 328.49004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C(CCCC(C(=O)O)N)N

Isomeric SMILES

CCCCCCCCCCCC(=O)C(CCC[C@@H](C(=O)O)N)N

InChI

InChI=1S/C18H36N2O3/c1-2-3-4-5-6-7-8-9-10-14-17(21)15(19)12-11-13-16(20)18(22)23/h15-16H,2-14,19-20H2,1H3,(H,22,23)/t15?,16-/m0/s1