3-[(4-methylphenyl)sulfonylamino]-3-(4-propoxyphenyl)propanoic acid

Systemtic Name: 3-[(4-methylphenyl)sulfonylamino]-3-(4-propoxyphenyl)propanoic acid Openeye Name: 3-(4-propoxyphenyl)-3-(p-tolylsulfonylamino)propanoic acid CAS Name: 3-[(4-methylphenyl)sulfonylamino]-3-(4-propoxyphenyl)propanoic acid IUPAC Name: 3-[(4-methylphenyl)sulfonylamino]-3-(4-propoxyphenyl)propanoic acid Traditional Name: 3-(4-propoxyphenyl)-3-(tosylamino)propionic acid Formula: C19H23NO5S MolecularWeight: 377.45462

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H23NO5S/c1-3-12-25-16-8-6-15(7-9-16)18(13-19(21)22)20-26(23,24)17-10-4-14(2)5-11-17/h4-11,18,20H,3,12-13H2,1-2H3,(H,21,22)