4-methoxy-N-[3-(2-methylpropoxy)propyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-methoxy-N-[3-(2-methylpropoxy)propyl]-3-nitro-benzenesulfonamide Openeye Name: N-(3-isobutoxypropyl)-4-methoxy-3-nitro-benzenesulfonamide CAS Name: 4-methoxy-N-[3-(2-methylpropoxy)propyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-methoxy-N-[3-(2-methylpropoxy)propyl]-3-nitrobenzenesulfonamide Traditional Name: N-(3-isobutoxypropyl)-4-methoxy-3-nitro-benzenesulfonamide Formula: C14H22N2O6S MolecularWeight: 346.39928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O6S/c1-11(2)10-22-8-4-7-15-23(19,20)12-5-6-14(21-3)13(9-12)16(17)18/h5-6,9,11,15H,4,7-8,10H2,1-3H3