4-[[4-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(5-chloro-1,3-benzoxazol-2-yl)anilino]-4-oxo-butanoic acid CAS Name: 4-[4-(5-chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid IUPAC Name: 4-[4-(5-chloro-1,3-benzoxazol-2-yl)anilino]-4-oxobutanoic acid Traditional Name: 4-[4-(5-chloro-1,3-benzoxazol-2-yl)anilino]-4-keto-butyric acid Formula: C17H13ClN2O4 MolecularWeight: 344.74912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(O2)C=CC(=C3)Cl)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(O2)C=CC(=C3)Cl)NC(=O)CCC(=O)O

InChI

InChI=1S/C17H13ClN2O4/c18-11-3-6-14-13(9-11)20-17(24-14)10-1-4-12(5-2-10)19-15(21)7-8-16(22)23/h1-6,9H,7-8H2,(H,19,21)(H,22,23)