(E)-2-(1,3-oxazol-2-yl)-3-(4-phenoxybutylcarbamoyl)-2-phenyl-7-pyridin-3-yl-hept-6-enoic acid

Systemtic Name: (E)-2-(1,3-oxazol-2-yl)-3-(4-phenoxybutylcarbamoyl)-2-phenyl-7-pyridin-3-yl-hept-6-enoic acid Openeye Name: (E)-2-oxazol-2-yl-3-(4-phenoxybutylcarbamoyl)-2-phenyl-7-(3-pyridyl)hept-6-enoic acid CAS Name: (E)-2-(2-oxazolyl)-3-[oxo-(4-phenoxybutylamino)methyl]-2-phenyl-7-(3-pyridinyl)-6-heptenoic acid IUPAC Name: (E)-2-(1,3-oxazol-2-yl)-3-(4-phenoxybutylcarbamoyl)-2-phenyl-7-pyridin-3-ylhept-6-enoic acid Traditional Name: (E)-2-oxazol-2-yl-3-(4-phenoxybutylcarbamoyl)-2-phenyl-7-(3-pyridyl)hept-6-enoic acid Formula: C32H33N3O5 MolecularWeight: 539.62152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=NC=CO2)(C(CCC=CC3=CN=CC=C3)C(=O)NCCCCOC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=NC=CO2)(C(CC/C=C/C3=CN=CC=C3)C(=O)NCCCCOC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C32H33N3O5/c36-29(34-20-9-10-22-39-27-16-5-2-6-17-27)28(18-8-7-12-25-13-11-19-33-24-25)32(31(37)38,30-35-21-23-40-30)26-14-3-1-4-15-26/h1-7,11-17,19,21,23-24,28H,8-10,18,20,22H2,(H,34,36)(H,37,38)/b12-7+