4-[3-(2-oxidanylidenecyclohexyl)prop-1-ynyl]benzenecarbonitrile

Systemtic Name: 4-[3-(2-oxidanylidenecyclohexyl)prop-1-ynyl]benzenecarbonitrile Openeye Name: 4-[3-(2-oxocyclohexyl)prop-1-ynyl]benzonitrile CAS Name: 4-[3-(2-oxocyclohexyl)prop-1-ynyl]benzonitrile IUPAC Name: 4-[3-(2-oxocyclohexyl)prop-1-ynyl]benzonitrile Traditional Name: 4-[3-(2-ketocyclohexyl)prop-1-ynyl]benzonitrile Formula: C16H15NO MolecularWeight: 237.2964

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)CC#CC2=CC=C(C=C2)C#N

Isomeric SMILES

C1CCC(=O)C(C1)CC#CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H15NO/c17-12-14-10-8-13(9-11-14)4-3-6-15-5-1-2-7-16(15)18/h8-11,15H,1-2,5-7H2