3-(hydroxymethyl)-2-phenyl-thiochromen-4-one

Systemtic Name: 3-(hydroxymethyl)-2-phenyl-thiochromen-4-one Openeye Name: 3-(hydroxymethyl)-2-phenyl-thiochromen-4-one CAS Name: 3-(hydroxymethyl)-2-phenyl-1-benzothiopyran-4-one IUPAC Name: 3-(hydroxymethyl)-2-phenylthiochromen-4-one Traditional Name: 3-methylol-2-phenyl-thiochromen-4-one Formula: C16H12O2S MolecularWeight: 268.33028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3S2)CO

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3S2)CO

InChI

InChI=1S/C16H12O2S/c17-10-13-15(18)12-8-4-5-9-14(12)19-16(13)11-6-2-1-3-7-11/h1-9,17H,10H2