(E)-3-[3-[(4-butylphenyl)sulfamoyl]-4,5-dimethoxy-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-[(4-butylphenyl)sulfamoyl]-4,5-dimethoxy-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-[(4-butylphenyl)sulfamoyl]-4,5-dimethoxy-phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-[(4-butylphenyl)sulfamoyl]-4,5-dimethoxyphenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-[(4-butylphenyl)sulfamoyl]-4,5-dimethoxyphenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-[(4-butylphenyl)sulfamoyl]-4,5-dimethoxy-phenyl]acrylic acid Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=CC(=C2OC)OC)C=CC(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=CC(=C2OC)OC)/C=C/C(=O)O

InChI

InChI=1S/C21H25NO6S/c1-4-5-6-15-7-10-17(11-8-15)22-29(25,26)19-14-16(9-12-20(23)24)13-18(27-2)21(19)28-3/h7-14,22H,4-6H2,1-3H3,(H,23,24)/b12-9+