2-chloranyl-5-nitro-N-propan-2-yl-N-propyl-benzenesulfonamide

Systemtic Name: 2-chloranyl-5-nitro-N-propan-2-yl-N-propyl-benzenesulfonamide Openeye Name: 2-chloro-N-isopropyl-5-nitro-N-propyl-benzenesulfonamide CAS Name: 2-chloro-5-nitro-N-propan-2-yl-N-propylbenzenesulfonamide IUPAC Name: 2-chloro-5-nitro-N-propan-2-yl-N-propylbenzenesulfonamide Traditional Name: 2-chloro-N-isopropyl-5-nitro-N-propyl-benzenesulfonamide Formula: C12H17ClN2O4S MolecularWeight: 320.79238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17ClN2O4S/c1-4-7-14(9(2)3)20(18,19)12-8-10(15(16)17)5-6-11(12)13/h5-6,8-9H,4,7H2,1-3H3