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

Systemtic Name: (2Z)-2-[[[4-(2-methylhexan-2-yl)phenyl]amino]-oxidanyl-methylidene]-3-oxidanylidene-butanenitrile Openeye Name: (2Z)-2-[[4-(1,1-dimethylpentyl)anilino]-hydroxy-methylene]-3-oxo-butanenitrile CAS Name: (2Z)-2-[hydroxy-[4-(2-methylhexan-2-yl)anilino]methylidene]-3-oxobutanenitrile IUPAC Name: (2Z)-2-[hydroxy-[4-(2-methylhexan-2-yl)anilino]methylidene]-3-oxobutanenitrile Traditional Name: (Z)-2-acetyl-3-[4-(1,1-dimethylpentyl)anilino]-3-hydroxy-acrylonitrile Formula: C18H24N2O2 MolecularWeight: 300.39536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C1=CC=C(C=C1)NC(=C(C#N)C(=O)C)O

Isomeric SMILES

CCCCC(C)(C)C1=CC=C(C=C1)N/C(=C(\C#N)/C(=O)C)/O

InChI

InChI=1S/C18H24N2O2/c1-5-6-11-18(3,4)14-7-9-15(10-8-14)20-17(22)16(12-19)13(2)21/h7-10,20,22H,5-6,11H2,1-4H3/b17-16-