(E)-3-[3,4-dimethoxy-5-[(2-methyl-1-phenyl-propyl)sulfamoyl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3,4-dimethoxy-5-[(2-methyl-1-phenyl-propyl)sulfamoyl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3,4-dimethoxy-5-[(2-methyl-1-phenyl-propyl)sulfamoyl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[3,4-dimethoxy-5-[(2-methyl-1-phenylpropyl)sulfamoyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3,4-dimethoxy-5-[(2-methyl-1-phenylpropyl)sulfamoyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[3,4-dimethoxy-5-[(2-methyl-1-phenyl-propyl)sulfamoyl]phenyl]acrylic acid Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO6S/c1-14(2)20(16-8-6-5-7-9-16)22-29(25,26)18-13-15(10-11-19(23)24)12-17(27-3)21(18)28-4/h5-14,20,22H,1-4H3,(H,23,24)/b11-10+