5-[3-[(E)-3-(2-methoxycarbonyl-3-oxidanyl-phenoxy)prop-1-enyl]phenyl]-1,2-oxazole-3-carboxylic acid

Systemtic Name: 5-[3-[(E)-3-(2-methoxycarbonyl-3-oxidanyl-phenoxy)prop-1-enyl]phenyl]-1,2-oxazole-3-carboxylic acid Openeye Name: 5-[3-[(E)-3-(3-hydroxy-2-methoxycarbonyl-phenoxy)prop-1-enyl]phenyl]isoxazole-3-carboxylic acid CAS Name: 5-[3-[(E)-3-(3-hydroxy-2-methoxycarbonylphenoxy)prop-1-enyl]phenyl]-3-isoxazolecarboxylic acid IUPAC Name: 5-[3-[(E)-3-(3-hydroxy-2-methoxycarbonylphenoxy)prop-1-enyl]phenyl]-1,2-oxazole-3-carboxylic acid Traditional Name: 5-[3-[(E)-3-(2-carbomethoxy-3-hydroxy-phenoxy)prop-1-enyl]phenyl]isoxazole-3-carboxylic acid Formula: C21H17NO7 MolecularWeight: 395.36218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC=C1OCC=CC2=CC=CC(=C2)C3=CC(=NO3)C(=O)O)O

Isomeric SMILES

COC(=O)C1=C(C=CC=C1OC/C=C/C2=CC=CC(=C2)C3=CC(=NO3)C(=O)O)O

InChI

InChI=1S/C21H17NO7/c1-27-21(26)19-16(23)8-3-9-17(19)28-10-4-6-13-5-2-7-14(11-13)18-12-15(20(24)25)22-29-18/h2-9,11-12,23H,10H2,1H3,(H,24,25)/b6-4+