N-(2-butoxy-5-methoxy-phenyl)-4-nitro-benzenesulfonamide

Systemtic Name: N-(2-butoxy-5-methoxy-phenyl)-4-nitro-benzenesulfonamide Openeye Name: N-(2-butoxy-5-methoxy-phenyl)-4-nitro-benzenesulfonamide CAS Name: N-(2-butoxy-5-methoxyphenyl)-4-nitrobenzenesulfonamide IUPAC Name: N-(2-butoxy-5-methoxyphenyl)-4-nitrobenzenesulfonamide Traditional Name: N-(2-butoxy-5-methoxy-phenyl)-4-nitro-benzenesulfonamide Formula: C17H20N2O6S MolecularWeight: 380.4155

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)OC)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)OC)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O6S/c1-3-4-11-25-17-10-7-14(24-2)12-16(17)18-26(22,23)15-8-5-13(6-9-15)19(20)21/h5-10,12,18H,3-4,11H2,1-2H3