4-nitro-5-(phenylmethyl)sulfonyl-pyridin-3-amine

Systemtic Name: 4-nitro-5-(phenylmethyl)sulfonyl-pyridin-3-amine Openeye Name: 5-benzylsulfonyl-4-nitro-pyridin-3-amine CAS Name: 4-nitro-5-(phenylmethyl)sulfonyl-3-pyridinamine IUPAC Name: 5-benzylsulfonyl-4-nitropyridin-3-amine Traditional Name: (5-benzylsulfonyl-4-nitro-3-pyridyl)amine Formula: C12H11N3O4S MolecularWeight: 293.29844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)C2=C(C(=CN=C2)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)C2=C(C(=CN=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O4S/c13-10-6-14-7-11(12(10)15(16)17)20(18,19)8-9-4-2-1-3-5-9/h1-7H,8,13H2