N-(3-azanylpropyl)-2-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(3-azanylpropyl)-2-methyl-3-nitro-benzenesulfonamide Openeye Name: N-(3-aminopropyl)-2-methyl-3-nitro-benzenesulfonamide CAS Name: N-(3-aminopropyl)-2-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(3-aminopropyl)-2-methyl-3-nitrobenzenesulfonamide Traditional Name: N-(3-aminopropyl)-2-methyl-3-nitro-benzenesulfonamide Formula: C10H15N3O4S MolecularWeight: 273.3088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)NCCCN)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)NCCCN)[N+](=O)[O-]

InChI

InChI=1S/C10H15N3O4S/c1-8-9(13(14)15)4-2-5-10(8)18(16,17)12-7-3-6-11/h2,4-5,12H,3,6-7,11H2,1H3