(3R)-3-(hexadecanoylamino)-4-(trimethylazaniumyl)butanoate

Systemtic Name: (3R)-3-(hexadecanoylamino)-4-(trimethylazaniumyl)butanoate Openeye Name: (3R)-3-(hexadecanoylamino)-4-(trimethylammonio)butanoate CAS Name: (3R)-3-(1-oxohexadecylamino)-4-(trimethylammonio)butanoate IUPAC Name: (3R)-3-(hexadecanoylamino)-4-(trimethylazaniumyl)butanoate Traditional Name: (3R)-3-palmitamido-4-(trimethylammonio)butyrate Formula: C23H46N2O3 MolecularWeight: 398.62294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(CC(=O)[O-])C[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N[C@H](CC(=O)[O-])C[N+](C)(C)C

InChI

InChI=1S/C23H46N2O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(26)24-21(19-23(27)28)20-25(2,3)4/h21H,5-20H2,1-4H3,(H-,24,26,27,28)/t21-/m1/s1