9-(3-nitrophenyl)sulfonylpurin-6-amine

Systemtic Name: 9-(3-nitrophenyl)sulfonylpurin-6-amine Openeye Name: 9-(3-nitrophenyl)sulfonylpurin-6-amine CAS Name: 9-(3-nitrophenyl)sulfonyl-6-purinamine IUPAC Name: 9-(3-nitrophenyl)sulfonylpurin-6-amine Traditional Name: [9-(3-nitrophenyl)sulfonylpurin-6-yl]amine Formula: C11H8N6O4S MolecularWeight: 320.28402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)N2C=NC3=C2N=CN=C3N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)N2C=NC3=C2N=CN=C3N)[N+](=O)[O-]

InChI

InChI=1S/C11H8N6O4S/c12-10-9-11(14-5-13-10)16(6-15-9)22(20,21)8-3-1-2-7(4-8)17(18)19/h1-6H,(H2,12,13,14)