N-(4-butan-2-yl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)-2-chloranyl-pyridine-3-carboxamide

Systemtic Name: N-(4-butan-2-yl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)-2-chloranyl-pyridine-3-carboxamide Openeye Name: 2-chloro-N-(3-oxo-4-sec-butyl-5H-1,4-benzoxazepin-7-yl)pyridine-3-carboxamide CAS Name: N-(4-butan-2-yl-3-oxo-5H-1,4-benzoxazepin-7-yl)-2-chloro-3-pyridinecarboxamide IUPAC Name: N-(4-butan-2-yl-3-oxo-5H-1,4-benzoxazepin-7-yl)-2-chloropyridine-3-carboxamide Traditional Name: 2-chloro-N-(3-keto-4-sec-butyl-5H-1,4-benzoxazepin-7-yl)nicotinamide Formula: C19H20ClN3O3 MolecularWeight: 373.8334

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CC2=C(C=CC(=C2)NC(=O)C3=C(N=CC=C3)Cl)OCC1=O

Isomeric SMILES

CCC(C)N1CC2=C(C=CC(=C2)NC(=O)C3=C(N=CC=C3)Cl)OCC1=O

InChI

InChI=1S/C19H20ClN3O3/c1-3-12(2)23-10-13-9-14(6-7-16(13)26-11-17(23)24)22-19(25)15-5-4-8-21-18(15)20/h4-9,12H,3,10-11H2,1-2H3,(H,22,25)