2-(5,5-dimethyl-8-phenyl-6H-naphthalen-2-yl)ethynyl benzoate

Systemtic Name: 2-(5,5-dimethyl-8-phenyl-6H-naphthalen-2-yl)ethynyl benzoate Openeye Name: 2-(5,5-dimethyl-8-phenyl-6H-naphthalen-2-yl)ethynyl benzoate CAS Name: benzoic acid 2-(5,5-dimethyl-8-phenyl-6H-naphthalen-2-yl)ethynyl ester IUPAC Name: 2-(5,5-dimethyl-8-phenyl-6H-naphthalen-2-yl)ethynyl benzoate Traditional Name: benzoic acid 2-(5,5-dimethyl-8-phenyl-6H-naphthalen-2-yl)ethynyl ester Formula: C27H22O2 MolecularWeight: 378.46238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=C(C2=C1C=CC(=C2)C#COC(=O)C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC=C(C2=C1C=CC(=C2)C#COC(=O)C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C27H22O2/c1-27(2)17-15-23(21-9-5-3-6-10-21)24-19-20(13-14-25(24)27)16-18-29-26(28)22-11-7-4-8-12-22/h3-15,19H,17H2,1-2H3