4-[(4E)-2-methyl-3-oxidanylidene-4-(1H-pyrimidin-6-ylidene)butan-2-yl]oxybenzenecarbonitrile

Systemtic Name: 4-[(4E)-2-methyl-3-oxidanylidene-4-(1H-pyrimidin-6-ylidene)butan-2-yl]oxybenzenecarbonitrile Openeye Name: 4-[(3E)-1,1-dimethyl-2-oxo-3-(1H-pyrimidin-6-ylidene)propoxy]benzonitrile CAS Name: 4-[(4E)-2-methyl-3-oxo-4-(1H-pyrimidin-6-ylidene)butan-2-yl]oxybenzonitrile IUPAC Name: 4-[(4E)-2-methyl-3-oxo-4-(1H-pyrimidin-6-ylidene)butan-2-yl]oxybenzonitrile Traditional Name: 4-[(3E)-2-keto-1,1-dimethyl-3-(1H-pyrimidin-6-ylidene)propoxy]benzonitrile Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C=C1C=CN=CN1)OC2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C(=O)/C=C/1\C=CN=CN1)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H15N3O2/c1-16(2,15(20)9-13-7-8-18-11-19-13)21-14-5-3-12(10-17)4-6-14/h3-9,11H,1-2H3,(H,18,19)/b13-9+