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

Systemtic Name: 4-methyl-N-[3-(2-methylpropoxy)propyl]-3-nitro-benzenesulfonamide Openeye Name: N-(3-isobutoxypropyl)-4-methyl-3-nitro-benzenesulfonamide CAS Name: 4-methyl-N-[3-(2-methylpropoxy)propyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-methyl-N-[3-(2-methylpropoxy)propyl]-3-nitrobenzenesulfonamide Traditional Name: N-(3-isobutoxypropyl)-4-methyl-3-nitro-benzenesulfonamide Formula: C14H22N2O5S MolecularWeight: 330.39988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCCOCC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCCOCC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H22N2O5S/c1-11(2)10-21-8-4-7-15-22(19,20)13-6-5-12(3)14(9-13)16(17)18/h5-6,9,11,15H,4,7-8,10H2,1-3H3