bicyclo[2.2.0]hexa-1(4),2,5-triene; 1-phenylbut-3-yn-1-one

Systemtic Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; 1-phenylbut-3-yn-1-one Openeye Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; 1-phenylbut-3-yn-1-one CAS Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; 1-phenyl-3-butyn-1-one IUPAC Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; 1-phenylbut-3-yn-1-one Traditional Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; 1-phenylbut-3-yn-1-one Formula: C16H12O MolecularWeight: 220.26588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCC(=O)C1=CC=CC=C1.C1=CC2=C1C=C2

Isomeric SMILES

C#CCC(=O)C1=CC=CC=C1.C1=CC2=C1C=C2

InChI

InChI=1S/C10H8O.C6H4/c1-2-6-10(11)9-7-4-3-5-8-9;1-2-6-4-3-5(1)6/h1,3-5,7-8H,6H2;1-4H