3-nitro-N-[3-(propan-2-ylamino)propyl]benzenesulfonamide

Systemtic Name: 3-nitro-N-[3-(propan-2-ylamino)propyl]benzenesulfonamide Openeye Name: N-[3-(isopropylamino)propyl]-3-nitro-benzenesulfonamide CAS Name: 3-nitro-N-[3-(propan-2-ylamino)propyl]benzenesulfonamide IUPAC Name: 3-nitro-N-[3-(propan-2-ylamino)propyl]benzenesulfonamide Traditional Name: N-[3-(isopropylamino)propyl]-3-nitro-benzenesulfonamide Formula: C12H19N3O4S MolecularWeight: 301.36196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19N3O4S/c1-10(2)13-7-4-8-14-20(18,19)12-6-3-5-11(9-12)15(16)17/h3,5-6,9-10,13-14H,4,7-8H2,1-2H3