4-azanyl-N-butyl-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-azanyl-N-butyl-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-amino-N-butyl-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-amino-N-butyl-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-amino-N-butyl-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-amino-N-butyl-N-methyl-3-nitro-benzenesulfonamide Formula: C11H17N3O4S MolecularWeight: 287.33538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)S(=O)(=O)C1=CC(=C(C=C1)N)[N+](=O)[O-]

Isomeric SMILES

CCCCN(C)S(=O)(=O)C1=CC(=C(C=C1)N)[N+](=O)[O-]

InChI

InChI=1S/C11H17N3O4S/c1-3-4-7-13(2)19(17,18)9-5-6-10(12)11(8-9)14(15)16/h5-6,8H,3-4,7,12H2,1-2H3