(2Z)-2-[[[4-(6-tert-butylpyridin-2-yl)phenyl]amino]-oxidanyl-methylidene]-3-oxidanylidene-butanenitrile

Systemtic Name: (2Z)-2-[[[4-(6-tert-butylpyridin-2-yl)phenyl]amino]-oxidanyl-methylidene]-3-oxidanylidene-butanenitrile Openeye Name: (2Z)-2-[[4-(6-tert-butyl-2-pyridyl)anilino]-hydroxy-methylene]-3-oxo-butanenitrile CAS Name: (2Z)-2-[[4-(6-tert-butyl-2-pyridinyl)anilino]-hydroxymethylidene]-3-oxobutanenitrile IUPAC Name: (2Z)-2-[[4-(6-tert-butylpyridin-2-yl)anilino]-hydroxymethylidene]-3-oxobutanenitrile Traditional Name: (Z)-2-acetyl-3-[4-(6-tert-butyl-2-pyridyl)anilino]-3-hydroxy-acrylonitrile Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C(NC1=CC=C(C=C1)C2=NC(=CC=C2)C(C)(C)C)O)C#N

Isomeric SMILES

CC(=O)/C(=C(/NC1=CC=C(C=C1)C2=NC(=CC=C2)C(C)(C)C)\O)/C#N

InChI

InChI=1S/C20H21N3O2/c1-13(24)16(12-21)19(25)22-15-10-8-14(9-11-15)17-6-5-7-18(23-17)20(2,3)4/h5-11,22,25H,1-4H3/b19-16-