(E)-2-(1,3-oxazol-2-yl)-2-phenyl-4-[(phenylmethyl)carbamoyl]-7-pyridin-3-yl-hept-6-enoic acid

Systemtic Name: (E)-2-(1,3-oxazol-2-yl)-2-phenyl-4-[(phenylmethyl)carbamoyl]-7-pyridin-3-yl-hept-6-enoic acid Openeye Name: (E)-4-(benzylcarbamoyl)-2-oxazol-2-yl-2-phenyl-7-(3-pyridyl)hept-6-enoic acid CAS Name: (E)-2-(2-oxazolyl)-4-[oxo-[(phenylmethyl)amino]methyl]-2-phenyl-7-(3-pyridinyl)-6-heptenoic acid IUPAC Name: (E)-4-(benzylcarbamoyl)-2-(1,3-oxazol-2-yl)-2-phenyl-7-pyridin-3-ylhept-6-enoic acid Traditional Name: (E)-4-(benzylcarbamoyl)-2-oxazol-2-yl-2-phenyl-7-(3-pyridyl)hept-6-enoic acid Formula: C29H27N3O4 MolecularWeight: 481.54238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(CC=CC2=CN=CC=C2)CC(C3=CC=CC=C3)(C4=NC=CO4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C(C/C=C/C2=CN=CC=C2)CC(C3=CC=CC=C3)(C4=NC=CO4)C(=O)O

InChI

InChI=1S/C29H27N3O4/c33-26(32-21-23-9-3-1-4-10-23)24(13-7-11-22-12-8-16-30-20-22)19-29(28(34)35,27-31-17-18-36-27)25-14-5-2-6-15-25/h1-12,14-18,20,24H,13,19,21H2,(H,32,33)(H,34,35)/b11-7+