N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-N-prop-2-enyl-benzenesulfonamide

Systemtic Name: N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-N-prop-2-enyl-benzenesulfonamide Openeye Name: N-allyl-3-nitro-N-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl]benzenesulfonamide CAS Name: N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-N-prop-2-enylbenzenesulfonamide IUPAC Name: N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-N-prop-2-enylbenzenesulfonamide Traditional Name: N-allyl-3-nitro-N-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl]benzenesulfonamide Formula: C19H18N4O5S MolecularWeight: 414.43502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)CN(CC=C)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)CN(CC=C)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O5S/c1-3-11-22(29(26,27)17-6-4-5-16(12-17)23(24)25)13-18-20-19(21-28-18)15-9-7-14(2)8-10-15/h3-10,12H,1,11,13H2,2H3