2-(decanoylamino)-3-oxidanyl-3-phenyl-propanoate

Systemtic Name: 2-(decanoylamino)-3-oxidanyl-3-phenyl-propanoate Openeye Name: 2-(decanoylamino)-3-hydroxy-3-phenyl-propanoate CAS Name: 3-hydroxy-2-(1-oxodecylamino)-3-phenylpropanoate IUPAC Name: 2-(decanoylamino)-3-hydroxy-3-phenylpropanoate Traditional Name: 2-(caprylamino)-3-hydroxy-3-phenyl-propionate Formula: C19H28NO4- MolecularWeight: 334.42992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)NC(C(C1=CC=CC=C1)O)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCC(=O)NC(C(C1=CC=CC=C1)O)C(=O)[O-]

InChI

InChI=1S/C19H29NO4/c1-2-3-4-5-6-7-11-14-16(21)20-17(19(23)24)18(22)15-12-9-8-10-13-15/h8-10,12-13,17-18,22H,2-7,11,14H2,1H3,(H,20,21)(H,23,24)/p-1