(phenylmethyl) (2S)-3-(4-hydroxyphenyl)-2-(octadecanoylamino)propanoate

Systemtic Name: (phenylmethyl) (2S)-3-(4-hydroxyphenyl)-2-(octadecanoylamino)propanoate Openeye Name: benzyl (2S)-3-(4-hydroxyphenyl)-2-(octadecanoylamino)propanoate CAS Name: (2S)-3-(4-hydroxyphenyl)-2-(1-oxooctadecylamino)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-3-(4-hydroxyphenyl)-2-(octadecanoylamino)propanoate Traditional Name: (2S)-3-(4-hydroxyphenyl)-2-stearamido-propionic acid benzyl ester Formula: C34H51NO4 MolecularWeight: 537.77304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(CC1=CC=C(C=C1)O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C34H51NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-33(37)35-32(27-29-23-25-31(36)26-24-29)34(38)39-28-30-20-17-16-18-21-30/h16-18,20-21,23-26,32,36H,2-15,19,22,27-28H2,1H3,(H,35,37)/t32-/m0/s1