4-nitro-N-(3-propan-2-yloxypropyl)benzenesulfonamide

Systemtic Name: 4-nitro-N-(3-propan-2-yloxypropyl)benzenesulfonamide Openeye Name: N-(3-isopropoxypropyl)-4-nitro-benzenesulfonamide CAS Name: 4-nitro-N-(3-propan-2-yloxypropyl)benzenesulfonamide IUPAC Name: 4-nitro-N-(3-propan-2-yloxypropyl)benzenesulfonamide Traditional Name: N-(3-isopropoxypropyl)-4-nitro-benzenesulfonamide Formula: C12H18N2O5S MolecularWeight: 302.34672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O5S/c1-10(2)19-9-3-8-13-20(17,18)12-6-4-11(5-7-12)14(15)16/h4-7,10,13H,3,8-9H2,1-2H3