3-[[(E)-4-oxidanylidenepent-2-en-2-yl]amino]benzenecarbonitrile

Systemtic Name: 3-[[(E)-4-oxidanylidenepent-2-en-2-yl]amino]benzenecarbonitrile Openeye Name: 3-[[(E)-1-methyl-3-oxo-but-1-enyl]amino]benzonitrile CAS Name: 3-[[(E)-4-oxopent-2-en-2-yl]amino]benzonitrile IUPAC Name: 3-[[(E)-4-oxopent-2-en-2-yl]amino]benzonitrile Traditional Name: 3-[[(E)-3-keto-1-methyl-but-1-enyl]amino]benzonitrile Formula: C12H12N2O MolecularWeight: 200.23648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O/c1-9(6-10(2)15)14-12-5-3-4-11(7-12)8-13/h3-7,14H,1-2H3/b9-6+