ethyl 4-[2-[5-(2-ethoxy-2-oxidanylidene-ethyl)-8,8-dimethyl-5-oxidanyl-6,7-dihydronaphthalen-2-yl]ethynyl]benzoate

Systemtic Name: ethyl 4-[2-[5-(2-ethoxy-2-oxidanylidene-ethyl)-8,8-dimethyl-5-oxidanyl-6,7-dihydronaphthalen-2-yl]ethynyl]benzoate Openeye Name: ethyl 4-[2-[1-(2-ethoxy-2-oxo-ethyl)-1-hydroxy-4,4-dimethyl-tetralin-6-yl]ethynyl]benzoate CAS Name: 4-[2-[5-(2-ethoxy-2-oxoethyl)-5-hydroxy-8,8-dimethyl-6,7-dihydronaphthalen-2-yl]ethynyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[5-(2-ethoxy-2-oxoethyl)-5-hydroxy-8,8-dimethyl-6,7-dihydronaphthalen-2-yl]ethynyl]benzoate Traditional Name: 4-[2-[1-(2-ethoxy-2-keto-ethyl)-1-hydroxy-4,4-dimethyl-tetralin-6-yl]ethynyl]benzoic acid ethyl ester Formula: C27H30O5 MolecularWeight: 434.5241

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1(CCC(C2=C1C=CC(=C2)C#CC3=CC=C(C=C3)C(=O)OCC)(C)C)O

Isomeric SMILES

CCOC(=O)CC1(CCC(C2=C1C=CC(=C2)C#CC3=CC=C(C=C3)C(=O)OCC)(C)C)O

InChI

InChI=1S/C27H30O5/c1-5-31-24(28)18-27(30)16-15-26(3,4)23-17-20(11-14-22(23)27)8-7-19-9-12-21(13-10-19)25(29)32-6-2/h9-14,17,30H,5-6,15-16,18H2,1-4H3