2-[[1-ethyl-2-(4-hydroxyphenyl)-6-oxidanyl-indol-3-yl]methyl]propanedinitrile

Systemtic Name: 2-[[1-ethyl-2-(4-hydroxyphenyl)-6-oxidanyl-indol-3-yl]methyl]propanedinitrile Openeye Name: 2-[[1-ethyl-6-hydroxy-2-(4-hydroxyphenyl)indol-3-yl]methyl]propanedinitrile CAS Name: 2-[[1-ethyl-6-hydroxy-2-(4-hydroxyphenyl)-3-indolyl]methyl]propanedinitrile IUPAC Name: 2-[[1-ethyl-6-hydroxy-2-(4-hydroxyphenyl)indol-3-yl]methyl]propanedinitrile Traditional Name: 2-[[1-ethyl-6-hydroxy-2-(4-hydroxyphenyl)indol-3-yl]methyl]malononitrile Formula: C20H17N3O2 MolecularWeight: 331.36788

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)O)C(=C1C3=CC=C(C=C3)O)CC(C#N)C#N

Isomeric SMILES

CCN1C2=C(C=CC(=C2)O)C(=C1C3=CC=C(C=C3)O)CC(C#N)C#N

InChI

InChI=1S/C20H17N3O2/c1-2-23-19-10-16(25)7-8-17(19)18(9-13(11-21)12-22)20(23)14-3-5-15(24)6-4-14/h3-8,10,13,24-25H,2,9H2,1H3