2-chloranyl-N-[2-methyl-4-(2-methylpropyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-[2-methyl-4-(2-methylpropyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]pyridine-3-carboxamide Openeye Name: 2-chloro-N-(4-isobutyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)pyridine-3-carboxamide CAS Name: 2-chloro-N-[2-methyl-4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[2-methyl-4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]pyridine-3-carboxamide Traditional Name: 2-chloro-N-(4-isobutyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)nicotinamide Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=C(N=CC=C3)Cl)CC(C)C

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=C(N=CC=C3)Cl)CC(C)C

InChI

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