3-methyl-N-(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-4-nitro-benzamide

Systemtic Name: 3-methyl-N-(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-4-nitro-benzamide Openeye Name: 3-methyl-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-4-nitro-benzamide CAS Name: 3-methyl-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-4-nitrobenzamide IUPAC Name: 3-methyl-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-4-nitrobenzamide Traditional Name: N-(6-keto-3-methyl-5H-benzo[b][1,4]benzoxazepin-8-yl)-3-methyl-4-nitro-benzamide Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])C)C(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])C)C(=O)N2

InChI

InChI=1S/C22H17N3O5/c1-12-3-7-20-17(9-12)24-22(27)16-11-15(5-8-19(16)30-20)23-21(26)14-4-6-18(25(28)29)13(2)10-14/h3-11H,1-2H3,(H,23,26)(H,24,27)