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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CC(=C(C2=CC(=C1)O)C3=CSC=C3C#N)C4=CC=C(C=C4)O

Isomeric SMILES

CC1=C2CC(=C(C2=CC(=C1)O)C3=CSC=C3C#N)C4=CC=C(C=C4)O

InChI

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