N-(3-methylbutan-2-yl)-7-nitro-1,1-bis(oxidanylidene)-4H-1$l^{6},2,4-benzothiadiazin-3-amine

Systemtic Name: N-(3-methylbutan-2-yl)-7-nitro-1,1-bis(oxidanylidene)-4H-1$l^{6},2,4-benzothiadiazin-3-amine Openeye Name: N-(1,2-dimethylpropyl)-7-nitro-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-amine CAS Name: N-(3-methylbutan-2-yl)-7-nitro-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-amine IUPAC Name: N-(3-methylbutan-2-yl)-7-nitro-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-amine Traditional Name: (1,1-diketo-7-nitro-4H-1$l^{6},2,4-benzothiadiazin-3-yl)-(1,2-dimethylpropyl)amine Formula: C12H16N4O4S MolecularWeight: 312.34484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC1=NS(=O)(=O)C2=C(N1)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C)NC1=NS(=O)(=O)C2=C(N1)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O4S/c1-7(2)8(3)13-12-14-10-5-4-9(16(17)18)6-11(10)21(19,20)15-12/h4-8H,1-3H3,(H2,13,14,15)