N-[3-(2,4-dimethylphenyl)propyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[3-(2,4-dimethylphenyl)propyl]-4-nitro-benzenesulfonamide Openeye Name: N-[3-(2,4-dimethylphenyl)propyl]-4-nitro-benzenesulfonamide CAS Name: N-[3-(2,4-dimethylphenyl)propyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[3-(2,4-dimethylphenyl)propyl]-4-nitrobenzenesulfonamide Traditional Name: N-[3-(2,4-dimethylphenyl)propyl]-4-nitro-benzenesulfonamide Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)CCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C17H20N2O4S/c1-13-5-6-15(14(2)12-13)4-3-11-18-24(22,23)17-9-7-16(8-10-17)19(20)21/h5-10,12,18H,3-4,11H2,1-2H3