(2S)-2-azanyl-3-[3,4-bis(2-phenylethanoyloxy)phenyl]propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[3,4-bis(2-phenylethanoyloxy)phenyl]propanoic acid Openeye Name: (2S)-2-amino-3-[3,4-bis[(2-phenylacetyl)oxy]phenyl]propanoic acid CAS Name: (2S)-2-amino-3-[3,4-bis(1-oxo-2-phenylethoxy)phenyl]propanoic acid IUPAC Name: (2S)-2-amino-3-[3,4-bis[(2-phenylacetyl)oxy]phenyl]propanoic acid Traditional Name: (2S)-2-amino-3-[3,4-bis[(2-phenylacetyl)oxy]phenyl]propionic acid Formula: C25H23NO6 MolecularWeight: 433.45322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)OC2=C(C=C(C=C2)CC(C(=O)O)N)OC(=O)CC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)OC2=C(C=C(C=C2)C[C@@H](C(=O)O)N)OC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C25H23NO6/c26-20(25(29)30)13-19-11-12-21(31-23(27)15-17-7-3-1-4-8-17)22(14-19)32-24(28)16-18-9-5-2-6-10-18/h1-12,14,20H,13,15-16,26H2,(H,29,30)/t20-/m0/s1