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

Systemtic Name: 2-[5-(2-ethoxy-2-oxidanylidene-ethyl)-8,8-dimethyl-5-oxidanyl-6,7-dihydronaphthalen-2-yl]ethynyl benzoate Openeye Name: 2-[1-(2-ethoxy-2-oxo-ethyl)-1-hydroxy-4,4-dimethyl-tetralin-6-yl]ethynyl benzoate CAS Name: benzoic acid 2-[5-(2-ethoxy-2-oxoethyl)-5-hydroxy-8,8-dimethyl-6,7-dihydronaphthalen-2-yl]ethynyl ester IUPAC Name: 2-[5-(2-ethoxy-2-oxoethyl)-5-hydroxy-8,8-dimethyl-6,7-dihydronaphthalen-2-yl]ethynyl benzoate Traditional Name: benzoic acid 2-[1-(2-ethoxy-2-keto-ethyl)-1-hydroxy-4,4-dimethyl-tetralin-6-yl]ethynyl ester Formula: C25H26O5 MolecularWeight: 406.47094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26O5/c1-4-29-22(26)17-25(28)14-13-24(2,3)21-16-18(10-11-20(21)25)12-15-30-23(27)19-8-6-5-7-9-19/h5-11,16,28H,4,13-14,17H2,1-3H3