N-(4-cyclopropyl-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)-4-nitro-benzamide

Systemtic Name: N-(4-cyclopropyl-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)-4-nitro-benzamide Openeye Name: N-(4-cyclopropyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-4-nitro-benzamide CAS Name: N-(4-cyclopropyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-4-nitrobenzamide IUPAC Name: N-(4-cyclopropyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-4-nitrobenzamide Traditional Name: N-(4-cyclopropyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)-4-nitro-benzamide Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4CC4

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4CC4

InChI

InChI=1S/C20H19N3O5/c1-12-20(25)22(16-7-8-16)11-14-10-15(4-9-18(14)28-12)21-19(24)13-2-5-17(6-3-13)23(26)27/h2-6,9-10,12,16H,7-8,11H2,1H3,(H,21,24)