3-(1-ethynylcyclohexyl)quinazolin-4-one

Systemtic Name: 3-(1-ethynylcyclohexyl)quinazolin-4-one Openeye Name: 3-(1-ethynylcyclohexyl)quinazolin-4-one CAS Name: 3-(1-ethynylcyclohexyl)-4-quinazolinone IUPAC Name: 3-(1-ethynylcyclohexyl)quinazolin-4-one Traditional Name: 3-(1-ethynylcyclohexyl)quinazolin-4-one Formula: C16H16N2O MolecularWeight: 252.31104

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(CCCCC1)N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

C#CC1(CCCCC1)N2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C16H16N2O/c1-2-16(10-6-3-7-11-16)18-12-17-14-9-5-4-8-13(14)15(18)19/h1,4-5,8-9,12H,3,6-7,10-11H2