N-(4-butyl-2-methyl-phenyl)-1-(2-nitrophenyl)methanesulfonamide

Systemtic Name: N-(4-butyl-2-methyl-phenyl)-1-(2-nitrophenyl)methanesulfonamide Openeye Name: N-(4-butyl-2-methyl-phenyl)-1-(2-nitrophenyl)methanesulfonamide CAS Name: N-(4-butyl-2-methylphenyl)-1-(2-nitrophenyl)methanesulfonamide IUPAC Name: N-(4-butyl-2-methylphenyl)-1-(2-nitrophenyl)methanesulfonamide Traditional Name: N-(4-butyl-2-methyl-phenyl)-1-(2-nitrophenyl)methanesulfonamide Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NS(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-])C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NS(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-])C

InChI

InChI=1S/C18H22N2O4S/c1-3-4-7-15-10-11-17(14(2)12-15)19-25(23,24)13-16-8-5-6-9-18(16)20(21)22/h5-6,8-12,19H,3-4,7,13H2,1-2H3