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

Systemtic Name: N-(3-ethyl-5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-(3-ethyl-5-keto-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-4,5-dimethoxy-2-nitro-benzamide Formula: C20H21N3O7 MolecularWeight: 415.39664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O7/c1-4-11-10-30-16-6-5-12(7-14(16)20(25)21-11)22-19(24)13-8-17(28-2)18(29-3)9-15(13)23(26)27/h5-9,11H,4,10H2,1-3H3,(H,21,25)(H,22,24)