2-methoxy-N-(3-methyl-1-phenyl-butyl)-4-nitro-benzenesulfonamide

Systemtic Name: 2-methoxy-N-(3-methyl-1-phenyl-butyl)-4-nitro-benzenesulfonamide Openeye Name: 2-methoxy-N-(3-methyl-1-phenyl-butyl)-4-nitro-benzenesulfonamide CAS Name: 2-methoxy-N-(3-methyl-1-phenylbutyl)-4-nitrobenzenesulfonamide IUPAC Name: 2-methoxy-N-(3-methyl-1-phenylbutyl)-4-nitrobenzenesulfonamide Traditional Name: 2-methoxy-N-(3-methyl-1-phenyl-butyl)-4-nitro-benzenesulfonamide Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O5S/c1-13(2)11-16(14-7-5-4-6-8-14)19-26(23,24)18-10-9-15(20(21)22)12-17(18)25-3/h4-10,12-13,16,19H,11H2,1-3H3