tetradecyl (2R,3S)-3-oxidanyl-3-phenyl-2-(2-phenylethanoylamino)propanoate

Systemtic Name: tetradecyl (2R,3S)-3-oxidanyl-3-phenyl-2-(2-phenylethanoylamino)propanoate Openeye Name: tetradecyl (2R,3S)-3-hydroxy-3-phenyl-2-[(2-phenylacetyl)amino]propanoate CAS Name: (2R,3S)-3-hydroxy-2-[(1-oxo-2-phenylethyl)amino]-3-phenylpropanoic acid tetradecyl ester IUPAC Name: tetradecyl (2R,3S)-3-hydroxy-3-phenyl-2-[(2-phenylacetyl)amino]propanoate Traditional Name: (2R,3S)-3-hydroxy-3-phenyl-2-[(2-phenylacetyl)amino]propionic acid myristyl ester Formula: C31H45NO4 MolecularWeight: 495.6933

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)C(C(C1=CC=CC=C1)O)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)[C@@H]([C@H](C1=CC=CC=C1)O)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C31H45NO4/c1-2-3-4-5-6-7-8-9-10-11-12-19-24-36-31(35)29(30(34)27-22-17-14-18-23-27)32-28(33)25-26-20-15-13-16-21-26/h13-18,20-23,29-30,34H,2-12,19,24-25H2,1H3,(H,32,33)/t29-,30+/m1/s1