4-chloranyl-3-nitro-N-propan-2-yl-N-propyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-3-nitro-N-propan-2-yl-N-propyl-benzenesulfonamide Openeye Name: 4-chloro-N-isopropyl-3-nitro-N-propyl-benzenesulfonamide CAS Name: 4-chloro-3-nitro-N-propan-2-yl-N-propylbenzenesulfonamide IUPAC Name: 4-chloro-3-nitro-N-propan-2-yl-N-propylbenzenesulfonamide Traditional Name: 4-chloro-N-isopropyl-3-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=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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