N-but-3-enyl-N-(4-methoxyphenyl)-2-nitro-benzenesulfonamide

Systemtic Name: N-but-3-enyl-N-(4-methoxyphenyl)-2-nitro-benzenesulfonamide Openeye Name: N-but-3-enyl-N-(4-methoxyphenyl)-2-nitro-benzenesulfonamide CAS Name: N-but-3-enyl-N-(4-methoxyphenyl)-2-nitrobenzenesulfonamide IUPAC Name: N-but-3-enyl-N-(4-methoxyphenyl)-2-nitrobenzenesulfonamide Traditional Name: N-but-3-enyl-N-(4-methoxyphenyl)-2-nitro-benzenesulfonamide Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CCC=C)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N(CCC=C)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O5S/c1-3-4-13-18(14-9-11-15(24-2)12-10-14)25(22,23)17-8-6-5-7-16(17)19(20)21/h3,5-12H,1,4,13H2,2H3