4-(8-chloranyl-5-oxidanylidene-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butanoic acid

Systemtic Name: 4-(8-chloranyl-5-oxidanylidene-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butanoic acid Openeye Name: 4-(8-chloro-5-oxo-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butanoic acid CAS Name: 4-(8-chloro-5-oxo-6-pyrido[2,3-b][1,5]benzoxazepinyl)butanoic acid IUPAC Name: 4-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6-yl)butanoic acid Traditional Name: 4-(8-chloro-5-keto-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butyric acid Formula: C16H13ClN2O4 MolecularWeight: 332.73842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(N=C1)OC3=C(C=C(C=C3)Cl)N(C2=O)CCCC(=O)O

Isomeric SMILES

C1=CC2=C(N=C1)OC3=C(C=C(C=C3)Cl)N(C2=O)CCCC(=O)O

InChI

InChI=1S/C16H13ClN2O4/c17-10-5-6-13-12(9-10)19(8-2-4-14(20)21)16(22)11-3-1-7-18-15(11)23-13/h1,3,5-7,9H,2,4,8H2,(H,20,21)