N,2-dimethyl-5-nitro-N-[(4-prop-2-enoxyphenyl)methyl]benzenesulfonamide

Systemtic Name: N,2-dimethyl-5-nitro-N-[(4-prop-2-enoxyphenyl)methyl]benzenesulfonamide Openeye Name: N-[(4-allyloxyphenyl)methyl]-N,2-dimethyl-5-nitro-benzenesulfonamide CAS Name: N,2-dimethyl-5-nitro-N-[(4-prop-2-enoxyphenyl)methyl]benzenesulfonamide IUPAC Name: N,2-dimethyl-5-nitro-N-[(4-prop-2-enoxyphenyl)methyl]benzenesulfonamide Traditional Name: N-(4-allyloxybenzyl)-N,2-dimethyl-5-nitro-benzenesulfonamide Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(C)CC2=CC=C(C=C2)OCC=C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(C)CC2=CC=C(C=C2)OCC=C

InChI

InChI=1S/C18H20N2O5S/c1-4-11-25-17-9-6-15(7-10-17)13-19(3)26(23,24)18-12-16(20(21)22)8-5-14(18)2/h4-10,12H,1,11,13H2,2-3H3