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

Systemtic Name: 4-chloranyl-3-nitro-N-(3-propan-2-yloxypropyl)benzenesulfonamide Openeye Name: 4-chloro-N-(3-isopropoxypropyl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-3-nitro-N-(3-propan-2-yloxypropyl)benzenesulfonamide IUPAC Name: 4-chloro-3-nitro-N-(3-propan-2-yloxypropyl)benzenesulfonamide Traditional Name: 4-chloro-N-(3-isopropoxypropyl)-3-nitro-benzenesulfonamide Formula: C12H17ClN2O5S MolecularWeight: 336.79178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17ClN2O5S/c1-9(2)20-7-3-6-14-21(18,19)10-4-5-11(13)12(8-10)15(16)17/h4-5,8-9,14H,3,6-7H2,1-2H3