2-acetamido-3-[3-[1-[2-(4-phenylmethoxyphenyl)ethanoyl]pyrrolidin-2-yl]-1,2-oxazol-5-yl]propanoic acid

Systemtic Name: 2-acetamido-3-[3-[1-[2-(4-phenylmethoxyphenyl)ethanoyl]pyrrolidin-2-yl]-1,2-oxazol-5-yl]propanoic acid Openeye Name: 2-acetamido-3-[3-[1-[2-(4-benzyloxyphenyl)acetyl]pyrrolidin-2-yl]isoxazol-5-yl]propanoic acid CAS Name: 2-acetamido-3-[3-[1-[1-oxo-2-(4-phenylmethoxyphenyl)ethyl]-2-pyrrolidinyl]-5-isoxazolyl]propanoic acid IUPAC Name: 2-acetamido-3-[3-[1-[2-(4-phenylmethoxyphenyl)acetyl]pyrrolidin-2-yl]-1,2-oxazol-5-yl]propanoic acid Traditional Name: 2-acetamido-3-[3-[1-[2-(4-benzoxyphenyl)acetyl]pyrrolidin-2-yl]isoxazol-5-yl]propionic acid Formula: C27H29N3O6 MolecularWeight: 491.53566

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC(=NO1)C2CCCN2C(=O)CC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(=O)NC(CC1=CC(=NO1)C2CCCN2C(=O)CC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C27H29N3O6/c1-18(31)28-24(27(33)34)16-22-15-23(29-36-22)25-8-5-13-30(25)26(32)14-19-9-11-21(12-10-19)35-17-20-6-3-2-4-7-20/h2-4,6-7,9-12,15,24-25H,5,8,13-14,16-17H2,1H3,(H,28,31)(H,33,34)