2-[[2-dodecyl-4-(2-hydroxyethyl)-3-oxidanylidene-tetradecanoyl]azaniumyl]ethanolate

Systemtic Name: 2-[[2-dodecyl-4-(2-hydroxyethyl)-3-oxidanylidene-tetradecanoyl]azaniumyl]ethanolate Openeye Name: 2-[[2-dodecyl-4-(2-hydroxyethyl)-3-oxo-tetradecanoyl]ammonio]ethanolate CAS Name: 2-[[2-dodecyl-4-(2-hydroxyethyl)-1,3-dioxotetradecyl]ammonio]ethanolate IUPAC Name: 2-[[2-dodecyl-4-(2-hydroxyethyl)-3-oxotetradecanoyl]azaniumyl]ethanolate Traditional Name: 2-[[4-(2-hydroxyethyl)-3-keto-2-lauryl-tetradecanoyl]ammonio]ethanolate Formula: C30H59NO4 MolecularWeight: 497.79376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(=O)C(CCCCCCCCCC)CCO)C(=O)[NH2+]CC[O-]

Isomeric SMILES

CCCCCCCCCCCCC(C(=O)C(CCCCCCCCCC)CCO)C(=O)[NH2+]CC[O-]

InChI

InChI=1S/C30H58NO4/c1-3-5-7-9-11-13-14-16-18-20-22-28(30(35)31-24-26-33)29(34)27(23-25-32)21-19-17-15-12-10-8-6-4-2/h27-28,32H,3-26H2,1-2H3,(H,31,35)/q-1/p+1