3-(naphthalen-2-ylsulfonylamino)-3-(3-phenoxyphenyl)propanoic acid

Systemtic Name: 3-(naphthalen-2-ylsulfonylamino)-3-(3-phenoxyphenyl)propanoic acid Openeye Name: 3-(2-naphthylsulfonylamino)-3-(3-phenoxyphenyl)propanoic acid CAS Name: 3-(2-naphthalenylsulfonylamino)-3-(3-phenoxyphenyl)propanoic acid IUPAC Name: 3-(naphthalen-2-ylsulfonylamino)-3-(3-phenoxyphenyl)propanoic acid Traditional Name: 3-(2-naphthylsulfonylamino)-3-(3-phenoxyphenyl)propionic acid Formula: C25H21NO5S MolecularWeight: 447.50294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C(CC(=O)O)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)C(CC(=O)O)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H21NO5S/c27-25(28)17-24(20-9-6-12-22(15-20)31-21-10-2-1-3-11-21)26-32(29,30)23-14-13-18-7-4-5-8-19(18)16-23/h1-16,24,26H,17H2,(H,27,28)