5-iodanyl-2-[[5-(4-methoxyphenyl)-4,5-dihydro-1,2-oxazol-3-yl]amino]benzoic acid

Systemtic Name: 5-iodanyl-2-[[5-(4-methoxyphenyl)-4,5-dihydro-1,2-oxazol-3-yl]amino]benzoic acid Openeye Name: 5-iodo-2-[[5-(4-methoxyphenyl)-4,5-dihydroisoxazol-3-yl]amino]benzoic acid CAS Name: 5-iodo-2-[[5-(4-methoxyphenyl)-4,5-dihydroisoxazol-3-yl]amino]benzoic acid IUPAC Name: 5-iodo-2-[[5-(4-methoxyphenyl)-4,5-dihydro-1,2-oxazol-3-yl]amino]benzoic acid Traditional Name: 5-iodo-2-[[5-(4-methoxyphenyl)-2-isoxazolin-3-yl]amino]benzoic acid Formula: C17H15IN2O4 MolecularWeight: 438.21647

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NO2)NC3=C(C=C(C=C3)I)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2CC(=NO2)NC3=C(C=C(C=C3)I)C(=O)O

InChI

InChI=1S/C17H15IN2O4/c1-23-12-5-2-10(3-6-12)15-9-16(20-24-15)19-14-7-4-11(18)8-13(14)17(21)22/h2-8,15H,9H2,1H3,(H,19,20)(H,21,22)