4-(2-methyl-3-oxidanylidene-4-pyrazin-2-yl-butan-2-yl)oxybenzenecarbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)CC1=NC=CN=C1)OC2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C(=O)CC1=NC=CN=C1)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H15N3O2/c1-16(2,15(20)9-13-11-18-7-8-19-13)21-14-5-3-12(10-17)4-6-14/h3-8,11H,9H2,1-2H3