2-(3,4-dihydro-2H-thiochromen-4-yl)-2-phenoxy-ethanoic acid

Systemtic Name: 2-(3,4-dihydro-2H-thiochromen-4-yl)-2-phenoxy-ethanoic acid Openeye Name: 2-phenoxy-2-thiochroman-4-yl-acetic acid CAS Name: 2-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-phenoxyacetic acid IUPAC Name: 2-(3,4-dihydro-2H-thiochromen-4-yl)-2-phenoxyacetic acid Traditional Name: 2-phenoxy-2-thiochroman-4-yl-acetic acid Formula: C17H16O3S MolecularWeight: 300.37214

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1C(C(=O)O)OC3=CC=CC=C3

Isomeric SMILES

C1CSC2=CC=CC=C2C1C(C(=O)O)OC3=CC=CC=C3

InChI

InChI=1S/C17H16O3S/c18-17(19)16(20-12-6-2-1-3-7-12)14-10-11-21-15-9-5-4-8-13(14)15/h1-9,14,16H,10-11H2,(H,18,19)