bis(1,2-oxazol-4-ylmethyl) 2-[azanyl(phenyl)methyl]-3-oxidanyl-5-(phenylmethyl)hexanedioate

Systemtic Name: bis(1,2-oxazol-4-ylmethyl) 2-[azanyl(phenyl)methyl]-3-oxidanyl-5-(phenylmethyl)hexanedioate Openeye Name: bis(isoxazol-4-ylmethyl) 2-[amino(phenyl)methyl]-5-benzyl-3-hydroxy-hexanedioate CAS Name: 2-[amino(phenyl)methyl]-3-hydroxy-5-(phenylmethyl)hexanedioic acid bis(4-isoxazolylmethyl) ester IUPAC Name: bis(1,2-oxazol-4-ylmethyl) 2-[amino(phenyl)methyl]-5-benzyl-3-hydroxyhexanedioate Traditional Name: 2-[amino(phenyl)methyl]-5-benzyl-3-hydroxy-adipic acid bis(isoxazol-4-ylmethyl) ester Formula: C28H29N3O7 MolecularWeight: 519.54576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC(C(C(C2=CC=CC=C2)N)C(=O)OCC3=CON=C3)O)C(=O)OCC4=CON=C4

Isomeric SMILES

C1=CC=C(C=C1)CC(CC(C(C(C2=CC=CC=C2)N)C(=O)OCC3=CON=C3)O)C(=O)OCC4=CON=C4

InChI

InChI=1S/C28H29N3O7/c29-26(22-9-5-2-6-10-22)25(28(34)36-16-21-14-31-38-18-21)24(32)12-23(11-19-7-3-1-4-8-19)27(33)35-15-20-13-30-37-17-20/h1-10,13-14,17-18,23-26,32H,11-12,15-16,29H2