N-[4-[(E)-3-(2-hydroxyphenyl)prop-2-enoyl]phenyl]-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[4-[(E)-3-(2-hydroxyphenyl)prop-2-enoyl]phenyl]-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-[4-[(E)-3-(2-hydroxyphenyl)prop-2-enoyl]phenyl]-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-[4-[(E)-3-(2-hydroxyphenyl)-1-oxoprop-2-enyl]phenyl]-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-[4-[(E)-3-(2-hydroxyphenyl)prop-2-enoyl]phenyl]-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-[4-[(E)-3-(2-hydroxyphenyl)acryloyl]phenyl]-2-methyl-5-nitro-benzenesulfonamide Formula: C22H18N2O6S MolecularWeight: 438.45312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)C(=O)C=CC3=CC=CC=C3O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)C(=O)/C=C/C3=CC=CC=C3O

InChI

InChI=1S/C22H18N2O6S/c1-15-6-12-19(24(27)28)14-22(15)31(29,30)23-18-10-7-17(8-11-18)21(26)13-9-16-4-2-3-5-20(16)25/h2-14,23,25H,1H3/b13-9+