ethyl 4-[2-(5-acetyloxy-8,8-dimethyl-7H-naphthalen-2-yl)ethynyl]benzoate

Systemtic Name: ethyl 4-[2-(5-acetyloxy-8,8-dimethyl-7H-naphthalen-2-yl)ethynyl]benzoate Openeye Name: ethyl 4-[2-(5-acetoxy-8,8-dimethyl-7H-naphthalen-2-yl)ethynyl]benzoate CAS Name: 4-[2-(5-acetyloxy-8,8-dimethyl-7H-naphthalen-2-yl)ethynyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(5-acetyloxy-8,8-dimethyl-7H-naphthalen-2-yl)ethynyl]benzoate Traditional Name: 4-[2-(5-acetoxy-8,8-dimethyl-7H-naphthalen-2-yl)ethynyl]benzoic acid ethyl ester Formula: C25H24O4 MolecularWeight: 388.45566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C(=CCC3(C)C)OC(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C(=CCC3(C)C)OC(=O)C

InChI

InChI=1S/C25H24O4/c1-5-28-24(27)20-11-8-18(9-12-20)6-7-19-10-13-21-22(16-19)25(3,4)15-14-23(21)29-17(2)26/h8-14,16H,5,15H2,1-4H3