4-azanyl-3-nitro-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-azanyl-3-nitro-N-(phenylmethyl)benzenesulfonamide Openeye Name: 4-amino-N-benzyl-3-nitro-benzenesulfonamide CAS Name: 4-amino-3-nitro-N-(phenylmethyl)benzenesulfonamide IUPAC Name: 4-amino-N-benzyl-3-nitrobenzenesulfonamide Traditional Name: 4-amino-N-benzyl-3-nitro-benzenesulfonamide Formula: C13H13N3O4S MolecularWeight: 307.32502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N3O4S/c14-12-7-6-11(8-13(12)16(17)18)21(19,20)15-9-10-4-2-1-3-5-10/h1-8,15H,9,14H2