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

Systemtic Name: 3-nitro-4-oxidanyl-N-propan-2-yl-N-propyl-benzenesulfonamide Openeye Name: 4-hydroxy-N-isopropyl-3-nitro-N-propyl-benzenesulfonamide CAS Name: 4-hydroxy-3-nitro-N-propan-2-yl-N-propylbenzenesulfonamide IUPAC Name: 4-hydroxy-3-nitro-N-propan-2-yl-N-propylbenzenesulfonamide Traditional Name: 4-hydroxy-N-isopropyl-3-nitro-N-propyl-benzenesulfonamide Formula: C12H18N2O5S MolecularWeight: 302.34672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O5S/c1-4-7-13(9(2)3)20(18,19)10-5-6-12(15)11(8-10)14(16)17/h5-6,8-9,15H,4,7H2,1-3H3