ethyl 5-[2-(2,6,6-trimethylcyclohexen-1-yl)ethynyl]-3H-indene-1-carboxylate

Systemtic Name: ethyl 5-[2-(2,6,6-trimethylcyclohexen-1-yl)ethynyl]-3H-indene-1-carboxylate Openeye Name: ethyl 5-[2-(2,6,6-trimethylcyclohexen-1-yl)ethynyl]-3H-indene-1-carboxylate CAS Name: 5-[2-(2,6,6-trimethyl-1-cyclohexenyl)ethynyl]-3H-indene-1-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(2,6,6-trimethylcyclohexen-1-yl)ethynyl]-3H-indene-1-carboxylate Traditional Name: 5-[2-(2,6,6-trimethylcyclohexen-1-yl)ethynyl]-3H-indene-1-carboxylic acid ethyl ester Formula: C23H26O2 MolecularWeight: 334.45134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CCC2=C1C=CC(=C2)C#CC3=C(CCCC3(C)C)C

Isomeric SMILES

CCOC(=O)C1=CCC2=C1C=CC(=C2)C#CC3=C(CCCC3(C)C)C

InChI

InChI=1S/C23H26O2/c1-5-25-22(24)20-12-10-18-15-17(8-11-19(18)20)9-13-21-16(2)7-6-14-23(21,3)4/h8,11-12,15H,5-7,10,14H2,1-4H3