2-(butylamino)-N-(2-methoxyphenyl)-5-nitro-benzenesulfonamide

Systemtic Name: 2-(butylamino)-N-(2-methoxyphenyl)-5-nitro-benzenesulfonamide Openeye Name: 2-(butylamino)-N-(2-methoxyphenyl)-5-nitro-benzenesulfonamide CAS Name: 2-(butylamino)-N-(2-methoxyphenyl)-5-nitrobenzenesulfonamide IUPAC Name: 2-(butylamino)-N-(2-methoxyphenyl)-5-nitrobenzenesulfonamide Traditional Name: 2-(butylamino)-N-(2-methoxyphenyl)-5-nitro-benzenesulfonamide Formula: C17H21N3O5S MolecularWeight: 379.43074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2OC

Isomeric SMILES

CCCCNC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2OC

InChI

InChI=1S/C17H21N3O5S/c1-3-4-11-18-15-10-9-13(20(21)22)12-17(15)26(23,24)19-14-7-5-6-8-16(14)25-2/h5-10,12,18-19H,3-4,11H2,1-2H3