5-chloranyl-N-(4-methyl-5-oxidanylidene-2,3-dihydro-1,4-benzoxazepin-7-yl)-2-nitro-benzamide

Systemtic Name: 5-chloranyl-N-(4-methyl-5-oxidanylidene-2,3-dihydro-1,4-benzoxazepin-7-yl)-2-nitro-benzamide Openeye Name: 5-chloro-N-(4-methyl-5-oxo-2,3-dihydro-1,4-benzoxazepin-7-yl)-2-nitro-benzamide CAS Name: 5-chloro-N-(4-methyl-5-oxo-2,3-dihydro-1,4-benzoxazepin-7-yl)-2-nitrobenzamide IUPAC Name: 5-chloro-N-(4-methyl-5-oxo-2,3-dihydro-1,4-benzoxazepin-7-yl)-2-nitrobenzamide Traditional Name: 5-chloro-N-(5-keto-4-methyl-2,3-dihydro-1,4-benzoxazepin-7-yl)-2-nitro-benzamide Formula: C17H14ClN3O5 MolecularWeight: 375.76316

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCOC2=C(C1=O)C=C(C=C2)NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1CCOC2=C(C1=O)C=C(C=C2)NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN3O5/c1-20-6-7-26-15-5-3-11(9-13(15)17(20)23)19-16(22)12-8-10(18)2-4-14(12)21(24)25/h2-5,8-9H,6-7H2,1H3,(H,19,22)