N-(3,4-dipropoxyphenyl)-4-nitro-benzenesulfonamide

Systemtic Name: N-(3,4-dipropoxyphenyl)-4-nitro-benzenesulfonamide Openeye Name: N-(3,4-dipropoxyphenyl)-4-nitro-benzenesulfonamide CAS Name: N-(3,4-dipropoxyphenyl)-4-nitrobenzenesulfonamide IUPAC Name: N-(3,4-dipropoxyphenyl)-4-nitrobenzenesulfonamide Traditional Name: N-(3,4-dipropoxyphenyl)-4-nitro-benzenesulfonamide Formula: C18H22N2O6S MolecularWeight: 394.44208

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OCCC

InChI

InChI=1S/C18H22N2O6S/c1-3-11-25-17-10-5-14(13-18(17)26-12-4-2)19-27(23,24)16-8-6-15(7-9-16)20(21)22/h5-10,13,19H,3-4,11-12H2,1-2H3