3-[2-[2-(1,3-benzoxazol-2-yl)phenyl]carbonyloxypropanoylamino]-4-chloranyl-benzoic acid

Systemtic Name: 3-[2-[2-(1,3-benzoxazol-2-yl)phenyl]carbonyloxypropanoylamino]-4-chloranyl-benzoic acid Openeye Name: 3-[2-[2-(1,3-benzoxazol-2-yl)benzoyl]oxypropanoylamino]-4-chloro-benzoic acid CAS Name: 3-[[2-[[2-(1,3-benzoxazol-2-yl)phenyl]-oxomethoxy]-1-oxopropyl]amino]-4-chlorobenzoic acid IUPAC Name: 3-[2-[2-(1,3-benzoxazol-2-yl)benzoyl]oxypropanoylamino]-4-chlorobenzoic acid Traditional Name: 3-[2-[2-(1,3-benzoxazol-2-yl)benzoyl]oxypropanoylamino]-4-chloro-benzoic acid Formula: C24H17ClN2O6 MolecularWeight: 464.85458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)C(=O)O)Cl)OC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)C(=O)O)Cl)OC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C24H17ClN2O6/c1-13(21(28)26-19-12-14(23(29)30)10-11-17(19)25)32-24(31)16-7-3-2-6-15(16)22-27-18-8-4-5-9-20(18)33-22/h2-13H,1H3,(H,26,28)(H,29,30)