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

Systemtic Name: 2-chloranyl-N-[2-ethyl-4-[(2-fluorophenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[2-ethyl-4-[(2-fluorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]pyridine-3-carboxamide CAS Name: 2-chloro-N-[2-ethyl-4-[(2-fluorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[2-ethyl-4-[(2-fluorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]pyridine-3-carboxamide Traditional Name: 2-chloro-N-[2-ethyl-4-(2-fluorobenzyl)-3-keto-5H-1,4-benzoxazepin-7-yl]nicotinamide Formula: C24H21ClFN3O3 MolecularWeight: 453.893243

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=C(N=CC=C3)Cl)CC4=CC=CC=C4F

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=C(N=CC=C3)Cl)CC4=CC=CC=C4F

InChI

InChI=1S/C24H21ClFN3O3/c1-2-20-24(31)29(13-15-6-3-4-8-19(15)26)14-16-12-17(9-10-21(16)32-20)28-23(30)18-7-5-11-27-22(18)25/h3-12,20H,2,13-14H2,1H3,(H,28,30)