2-azanyl-3-[5-oxidanyl-4,5-bis(phenylmethoxy)cyclohexa-1,3-dien-1-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[5-oxidanyl-4,5-bis(phenylmethoxy)cyclohexa-1,3-dien-1-yl]propanoic acid Openeye Name: 2-amino-3-(4,5-dibenzyloxy-5-hydroxy-cyclohexa-1,3-dien-1-yl)propanoic acid CAS Name: 2-amino-3-[5-hydroxy-4,5-bis(phenylmethoxy)-1-cyclohexa-1,3-dienyl]propanoic acid IUPAC Name: 2-amino-3-[5-hydroxy-4,5-bis(phenylmethoxy)cyclohexa-1,3-dien-1-yl]propanoic acid Traditional Name: 2-amino-3-(4,5-dibenzoxy-5-hydroxy-cyclohexa-1,3-dien-1-yl)propionic acid Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC=C(C1(O)OCC2=CC=CC=C2)OCC3=CC=CC=C3)CC(C(=O)O)N

Isomeric SMILES

C1C(=CC=C(C1(O)OCC2=CC=CC=C2)OCC3=CC=CC=C3)CC(C(=O)O)N

InChI

InChI=1S/C23H25NO5/c24-20(22(25)26)13-19-11-12-21(28-15-17-7-3-1-4-8-17)23(27,14-19)29-16-18-9-5-2-6-10-18/h1-12,20,27H,13-16,24H2,(H,25,26)