N-cyclopentyl-6-nitro-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine

Systemtic Name: N-cyclopentyl-6-nitro-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine Openeye Name: N-cyclopentyl-6-nitro-1,1-dioxo-1,2-benzothiazol-3-amine CAS Name: N-cyclopentyl-6-nitro-1,1-dioxo-1,2-benzothiazol-3-amine IUPAC Name: N-cyclopentyl-6-nitro-1,1-dioxo-1,2-benzothiazol-3-amine Traditional Name: cyclopentyl-(1,1-diketo-6-nitro-1,2-benzothiazol-3-yl)amine Formula: C12H13N3O4S MolecularWeight: 295.31432

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NS(=O)(=O)C3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)NC2=NS(=O)(=O)C3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O4S/c16-15(17)9-5-6-10-11(7-9)20(18,19)14-12(10)13-8-3-1-2-4-8/h5-8H,1-4H2,(H,13,14)