3-(3,4-dimethoxyphenyl)-2-[[4-(4-dimethylaminophenyl)phenyl]sulfonylamino]propanoic acid

Systemtic Name: 3-(3,4-dimethoxyphenyl)-2-[[4-(4-dimethylaminophenyl)phenyl]sulfonylamino]propanoic acid Openeye Name: 3-(3,4-dimethoxyphenyl)-2-[[4-(4-dimethylaminophenyl)phenyl]sulfonylamino]propanoic acid CAS Name: 3-(3,4-dimethoxyphenyl)-2-[[4-(4-dimethylaminophenyl)phenyl]sulfonylamino]propanoic acid IUPAC Name: 3-(3,4-dimethoxyphenyl)-2-[[4-(4-dimethylaminophenyl)phenyl]sulfonylamino]propanoic acid Traditional Name: 3-(3,4-dimethoxyphenyl)-2-[[4-(4-dimethylaminophenyl)phenyl]sulfonylamino]propionic acid Formula: C25H28N2O6S MolecularWeight: 484.56462

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CC3=CC(=C(C=C3)OC)OC)C(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CC3=CC(=C(C=C3)OC)OC)C(=O)O

InChI

InChI=1S/C25H28N2O6S/c1-27(2)20-10-6-18(7-11-20)19-8-12-21(13-9-19)34(30,31)26-22(25(28)29)15-17-5-14-23(32-3)24(16-17)33-4/h5-14,16,22,26H,15H2,1-4H3,(H,28,29)