2-[methylsulfonyl-[2-(naphthalen-2-ylmethyl)-1-benzofuran-5-yl]amino]ethanoic acid

Systemtic Name: 2-[methylsulfonyl-[2-(naphthalen-2-ylmethyl)-1-benzofuran-5-yl]amino]ethanoic acid Openeye Name: 2-[methylsulfonyl-[2-(2-naphthylmethyl)benzofuran-5-yl]amino]acetic acid CAS Name: 2-[methylsulfonyl-[2-(2-naphthalenylmethyl)-5-benzofuranyl]amino]acetic acid IUPAC Name: 2-[methylsulfonyl-[2-(naphthalen-2-ylmethyl)-1-benzofuran-5-yl]amino]acetic acid Traditional Name: 2-[mesyl-[2-(2-naphthylmethyl)benzofuran-5-yl]amino]acetic acid Formula: C22H19NO5S MolecularWeight: 409.45496

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)O)C1=CC2=C(C=C1)OC(=C2)CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CS(=O)(=O)N(CC(=O)O)C1=CC2=C(C=C1)OC(=C2)CC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H19NO5S/c1-29(26,27)23(14-22(24)25)19-8-9-21-18(12-19)13-20(28-21)11-15-6-7-16-4-2-3-5-17(16)10-15/h2-10,12-13H,11,14H2,1H3,(H,24,25)