ethyl 4-[2-[1,1-dimethyl-3-(4-methylphenyl)inden-5-yl]ethynyl]benzoate

Systemtic Name: ethyl 4-[2-[1,1-dimethyl-3-(4-methylphenyl)inden-5-yl]ethynyl]benzoate Openeye Name: ethyl 4-[2-[1,1-dimethyl-3-(p-tolyl)inden-5-yl]ethynyl]benzoate CAS Name: 4-[2-[1,1-dimethyl-3-(4-methylphenyl)-5-indenyl]ethynyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[1,1-dimethyl-3-(4-methylphenyl)inden-5-yl]ethynyl]benzoate Traditional Name: 4-[2-[1,1-dimethyl-3-(p-tolyl)inden-5-yl]ethynyl]benzoic acid ethyl ester Formula: C29H26O2 MolecularWeight: 406.51554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C(C=C3C4=CC=C(C=C4)C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C(C=C3C4=CC=C(C=C4)C)(C)C

InChI

InChI=1S/C29H26O2/c1-5-31-28(30)24-15-10-21(11-16-24)8-9-22-12-17-27-25(18-22)26(19-29(27,3)4)23-13-6-20(2)7-14-23/h6-7,10-19H,5H2,1-4H3