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

Systemtic Name: 2-chloranyl-N-(3-ethyl-5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-4-nitro-benzamide Openeye Name: 2-chloro-N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-4-nitro-benzamide CAS Name: 2-chloro-N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-4-nitrobenzamide IUPAC Name: 2-chloro-N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-4-nitrobenzamide Traditional Name: 2-chloro-N-(3-ethyl-5-keto-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-4-nitro-benzamide Formula: C18H16ClN3O5 MolecularWeight: 389.78974

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Descriptors Computed from Structure

Canonical SMILES:

CCC1COC2=C(C=C(C=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C(=O)N1

Isomeric SMILES

CCC1COC2=C(C=C(C=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C(=O)N1

InChI

InChI=1S/C18H16ClN3O5/c1-2-10-9-27-16-6-3-11(7-14(16)18(24)20-10)21-17(23)13-5-4-12(22(25)26)8-15(13)19/h3-8,10H,2,9H2,1H3,(H,20,24)(H,21,23)