3-[4-[(5-tert-butyl-1,2-oxazol-3-yl)carbamoylamino]phenoxy]benzoic acid

Systemtic Name: 3-[4-[(5-tert-butyl-1,2-oxazol-3-yl)carbamoylamino]phenoxy]benzoic acid Openeye Name: 3-[4-[(5-tert-butylisoxazol-3-yl)carbamoylamino]phenoxy]benzoic acid CAS Name: 3-[4-[[[(5-tert-butyl-3-isoxazolyl)amino]-oxomethyl]amino]phenoxy]benzoic acid IUPAC Name: 3-[4-[(5-tert-butyl-1,2-oxazol-3-yl)carbamoylamino]phenoxy]benzoic acid Traditional Name: 3-[4-[(5-tert-butylisoxazol-3-yl)carbamoylamino]phenoxy]benzoic acid Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NO1)NC(=O)NC2=CC=C(C=C2)OC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=NO1)NC(=O)NC2=CC=C(C=C2)OC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C21H21N3O5/c1-21(2,3)17-12-18(24-29-17)23-20(27)22-14-7-9-15(10-8-14)28-16-6-4-5-13(11-16)19(25)26/h4-12H,1-3H3,(H,25,26)(H2,22,23,24,27)