4-imidazol-1-yl-N-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-3-nitro-benzamide

Systemtic Name: 4-imidazol-1-yl-N-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-3-nitro-benzamide Openeye Name: 4-imidazol-1-yl-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-3-nitro-benzamide CAS Name: 4-(1-imidazolyl)-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-3-nitrobenzamide IUPAC Name: 4-imidazol-1-yl-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-3-nitrobenzamide Traditional Name: 4-imidazol-1-yl-N-(3-keto-2-methyl-4H-1,4-benzoxazin-6-yl)-3-nitro-benzamide Formula: C19H15N5O5 MolecularWeight: 393.3529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H15N5O5/c1-11-18(25)22-14-9-13(3-5-17(14)29-11)21-19(26)12-2-4-15(16(8-12)24(27)28)23-7-6-20-10-23/h2-11H,1H3,(H,21,26)(H,22,25)