N-butyl-4-(8-chloranyl-5-oxidanylidene-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butanamide

Systemtic Name: N-butyl-4-(8-chloranyl-5-oxidanylidene-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butanamide Openeye Name: N-butyl-4-(8-chloro-5-oxo-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butanamide CAS Name: N-butyl-4-(8-chloro-5-oxo-6-pyrido[2,3-b][1,5]benzoxazepinyl)butanamide IUPAC Name: N-butyl-4-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6-yl)butanamide Traditional Name: N-butyl-4-(8-chloro-5-keto-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butyramide Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CCCN1C2=C(C=CC(=C2)Cl)OC3=C(C1=O)C=CC=N3

Isomeric SMILES

CCCCNC(=O)CCCN1C2=C(C=CC(=C2)Cl)OC3=C(C1=O)C=CC=N3

InChI

InChI=1S/C20H22ClN3O3/c1-2-3-10-22-18(25)7-5-12-24-16-13-14(21)8-9-17(16)27-19-15(20(24)26)6-4-11-23-19/h4,6,8-9,11,13H,2-3,5,7,10,12H2,1H3,(H,22,25)