4-[3-nitro-4-(1,2,4-triazol-4-yl)phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-nitro-4-(1,2,4-triazol-4-yl)phenyl]sulfonylmorpholine Openeye Name: 4-[3-nitro-4-(1,2,4-triazol-4-yl)phenyl]sulfonylmorpholine CAS Name: 4-[3-nitro-4-(1,2,4-triazol-4-yl)phenyl]sulfonylmorpholine IUPAC Name: 4-[3-nitro-4-(1,2,4-triazol-4-yl)phenyl]sulfonylmorpholine Traditional Name: 4-[3-nitro-4-(1,2,4-triazol-4-yl)phenyl]sulfonylmorpholine Formula: C12H13N5O5S MolecularWeight: 339.32712

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)N3C=NN=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)N3C=NN=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O5S/c18-17(19)12-7-10(1-2-11(12)15-8-13-14-9-15)23(20,21)16-3-5-22-6-4-16/h1-2,7-9H,3-6H2