2-[6-(1,3-benzothiazol-2-ylmethoxy)naphthalen-2-yl]-2-methyl-propanoic acid

Systemtic Name: 2-[6-(1,3-benzothiazol-2-ylmethoxy)naphthalen-2-yl]-2-methyl-propanoic acid Openeye Name: 2-[6-(1,3-benzothiazol-2-ylmethoxy)-2-naphthyl]-2-methyl-propanoic acid CAS Name: 2-[6-(1,3-benzothiazol-2-ylmethoxy)-2-naphthalenyl]-2-methylpropanoic acid IUPAC Name: 2-[6-(1,3-benzothiazol-2-ylmethoxy)naphthalen-2-yl]-2-methylpropanoic acid Traditional Name: 2-[6-(1,3-benzothiazol-2-ylmethoxy)-2-naphthyl]-2-methyl-propionic acid Formula: C22H19NO3S MolecularWeight: 377.45616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC2=C(C=C1)C=C(C=C2)OCC3=NC4=CC=CC=C4S3)C(=O)O

Isomeric SMILES

CC(C)(C1=CC2=C(C=C1)C=C(C=C2)OCC3=NC4=CC=CC=C4S3)C(=O)O

InChI

InChI=1S/C22H19NO3S/c1-22(2,21(24)25)16-9-7-15-12-17(10-8-14(15)11-16)26-13-20-23-18-5-3-4-6-19(18)27-20/h3-12H,13H2,1-2H3,(H,24,25)