2-(4-sulfamoylphenoxy)ethyl (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-enoate

Systemtic Name: 2-(4-sulfamoylphenoxy)ethyl (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-enoate Openeye Name: 2-(4-sulfamoylphenoxy)ethyl (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-propenoic acid 2-(4-sulfamoylphenoxy)ethyl ester IUPAC Name: 2-(4-sulfamoylphenoxy)ethyl (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acrylic acid 2-(4-sulfamoylphenoxy)ethyl ester Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC(=O)OCCOC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=C/C(=O)OCCOC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C22H23N3O5S/c1-16-21(17(2)25(24-16)18-6-4-3-5-7-18)12-13-22(26)30-15-14-29-19-8-10-20(11-9-19)31(23,27)28/h3-13H,14-15H2,1-2H3,(H2,23,27,28)/b13-12+