4-(7-chloranyl-3-oxidanylidene-5H-1,4-benzoxazepin-4-yl)benzoic acid

Systemtic Name: 4-(7-chloranyl-3-oxidanylidene-5H-1,4-benzoxazepin-4-yl)benzoic acid Openeye Name: 4-(7-chloro-3-oxo-5H-1,4-benzoxazepin-4-yl)benzoic acid CAS Name: 4-(7-chloro-3-oxo-5H-1,4-benzoxazepin-4-yl)benzoic acid IUPAC Name: 4-(7-chloro-3-oxo-5H-1,4-benzoxazepin-4-yl)benzoic acid Traditional Name: 4-(7-chloro-3-keto-5H-1,4-benzoxazepin-4-yl)benzoic acid Formula: C16H12ClNO4 MolecularWeight: 317.72378

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)Cl)OCC(=O)N1C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1C2=C(C=CC(=C2)Cl)OCC(=O)N1C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H12ClNO4/c17-12-3-6-14-11(7-12)8-18(15(19)9-22-14)13-4-1-10(2-5-13)16(20)21/h1-7H,8-9H2,(H,20,21)