2-(2-phenylethynyl)-6,7,8,9,9a,10-hexahydro-5aH-benzo[g]quinolin-5-one

Systemtic Name: 2-(2-phenylethynyl)-6,7,8,9,9a,10-hexahydro-5aH-benzo[g]quinolin-5-one Openeye Name: 2-(2-phenylethynyl)-6,7,8,9,9a,10-hexahydro-5aH-benzo[g]quinolin-5-one CAS Name: 2-(2-phenylethynyl)-6,7,8,9,9a,10-hexahydro-5aH-benzo[g]quinolin-5-one IUPAC Name: 2-(2-phenylethynyl)-6,7,8,9,9a,10-hexahydro-5aH-benzo[g]quinolin-5-one Traditional Name: 2-(2-phenylethynyl)-6,7,8,9,9a,10-hexahydro-5aH-benzo[g]quinolin-5-one Formula: C21H19NO MolecularWeight: 301.38166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)CC3=C(C2=O)C=CC(=N3)C#CC4=CC=CC=C4

Isomeric SMILES

C1CCC2C(C1)CC3=C(C2=O)C=CC(=N3)C#CC4=CC=CC=C4

InChI

InChI=1S/C21H19NO/c23-21-18-9-5-4-8-16(18)14-20-19(21)13-12-17(22-20)11-10-15-6-2-1-3-7-15/h1-3,6-7,12-13,16,18H,4-5,8-9,14H2