2-(3,4-dihydro-2H-thiochromen-4-yl)-2-phenyl-propanoic acid

Systemtic Name: 2-(3,4-dihydro-2H-thiochromen-4-yl)-2-phenyl-propanoic acid Openeye Name: 2-phenyl-2-thiochroman-4-yl-propanoic acid CAS Name: 2-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-phenylpropanoic acid IUPAC Name: 2-(3,4-dihydro-2H-thiochromen-4-yl)-2-phenylpropanoic acid Traditional Name: 2-phenyl-2-thiochroman-4-yl-propionic acid Formula: C18H18O2S MolecularWeight: 298.39932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCSC2=CC=CC=C12)(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C1CCSC2=CC=CC=C12)(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H18O2S/c1-18(17(19)20,13-7-3-2-4-8-13)15-11-12-21-16-10-6-5-9-14(15)16/h2-10,15H,11-12H2,1H3,(H,19,20)