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

Systemtic Name: N-(3,3-dimethyl-4-oxidanylidene-5-prop-2-enyl-2H-1,5-benzoxazepin-7-yl)-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-(5-allyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-(3,3-dimethyl-4-oxo-5-prop-2-enyl-2H-1,5-benzoxazepin-7-yl)-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-(3,3-dimethyl-4-oxo-5-prop-2-enyl-2H-1,5-benzoxazepin-7-yl)-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-(5-allyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-7-yl)-4,5-dimethoxy-2-nitro-benzamide Formula: C23H25N3O7 MolecularWeight: 455.4605

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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)N(C1=O)CC=C)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)N(C1=O)CC=C)C

InChI

InChI=1S/C23H25N3O7/c1-6-9-25-17-10-14(7-8-18(17)33-13-23(2,3)22(25)28)24-21(27)15-11-19(31-4)20(32-5)12-16(15)26(29)30/h6-8,10-12H,1,9,13H2,2-5H3,(H,24,27)