(3S)-4-oxidanylidene-4-phenylmethoxy-3-(tetradecanoylamino)butanoic acid

Systemtic Name: (3S)-4-oxidanylidene-4-phenylmethoxy-3-(tetradecanoylamino)butanoic acid Openeye Name: (3S)-4-benzyloxy-4-oxo-3-(tetradecanoylamino)butanoic acid CAS Name: (3S)-4-oxo-3-(1-oxotetradecylamino)-4-phenylmethoxybutanoic acid IUPAC Name: (3S)-4-oxo-4-phenylmethoxy-3-(tetradecanoylamino)butanoic acid Traditional Name: (3S)-4-benzoxy-4-keto-3-(tetradecanoylamino)butyric acid Formula: C25H39NO5 MolecularWeight: 433.58086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)NC(CC(=O)O)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCC(=O)N[C@@H](CC(=O)O)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C25H39NO5/c1-2-3-4-5-6-7-8-9-10-11-15-18-23(27)26-22(19-24(28)29)25(30)31-20-21-16-13-12-14-17-21/h12-14,16-17,22H,2-11,15,18-20H2,1H3,(H,26,27)(H,28,29)/t22-/m0/s1