3-[2-(4-hydroxyphenyl)-4-methyl-6-oxidanyl-3H-inden-1-yl]thiophene-2-carbonitrile

Systemtic Name: 3-[2-(4-hydroxyphenyl)-4-methyl-6-oxidanyl-3H-inden-1-yl]thiophene-2-carbonitrile Openeye Name: 3-[6-hydroxy-2-(4-hydroxyphenyl)-4-methyl-3H-inden-1-yl]thiophene-2-carbonitrile CAS Name: 3-[6-hydroxy-2-(4-hydroxyphenyl)-4-methyl-3H-inden-1-yl]-2-thiophenecarbonitrile IUPAC Name: 3-[6-hydroxy-2-(4-hydroxyphenyl)-4-methyl-3H-inden-1-yl]thiophene-2-carbonitrile Traditional Name: 3-[6-hydroxy-2-(4-hydroxyphenyl)-4-methyl-3H-inden-1-yl]thiophene-2-carbonitrile Formula: C21H15NO2S MolecularWeight: 345.4143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CC(=C(C2=CC(=C1)O)C3=C(SC=C3)C#N)C4=CC=C(C=C4)O

Isomeric SMILES

CC1=C2CC(=C(C2=CC(=C1)O)C3=C(SC=C3)C#N)C4=CC=C(C=C4)O

InChI

InChI=1S/C21H15NO2S/c1-12-8-15(24)9-19-17(12)10-18(13-2-4-14(23)5-3-13)21(19)16-6-7-25-20(16)11-22/h2-9,23-24H,10H2,1H3