4-nitro-N-(oxan-4-yl)-1,3-benzothiazol-5-amine

Systemtic Name: 4-nitro-N-(oxan-4-yl)-1,3-benzothiazol-5-amine Openeye Name: 4-nitro-N-tetrahydropyran-4-yl-1,3-benzothiazol-5-amine CAS Name: 4-nitro-N-(4-oxanyl)-1,3-benzothiazol-5-amine IUPAC Name: 4-nitro-N-(oxan-4-yl)-1,3-benzothiazol-5-amine Traditional Name: (4-nitro-1,3-benzothiazol-5-yl)-tetrahydropyran-4-yl-amine Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1NC2=C(C3=C(C=C2)SC=N3)[N+](=O)[O-]

Isomeric SMILES

C1COCCC1NC2=C(C3=C(C=C2)SC=N3)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O3S/c16-15(17)12-9(14-8-3-5-18-6-4-8)1-2-10-11(12)13-7-19-10/h1-2,7-8,14H,3-6H2