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

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

CC1(COC2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C(=O)N1)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C(=O)N1)C

InChI

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