N-(2,3-dimethylcyclohexyl)-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-(2,3-dimethylcyclohexyl)-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-(2,3-dimethylcyclohexyl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-(2,3-dimethylcyclohexyl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-(2,3-dimethylcyclohexyl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-(2,3-dimethylcyclohexyl)-2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetamide Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCC(C1C)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O5/c1-11-4-3-5-14(12(11)2)19-17(22)9-20-15-8-13(21(24)25)6-7-16(15)26-10-18(20)23/h6-8,11-12,14H,3-5,9-10H2,1-2H3,(H,19,22)