ethyl 4-[2-[5,5-dimethyl-8-(5-methylthiophen-2-yl)-6H-naphthalen-2-yl]ethynyl]benzoate

Systemtic Name: ethyl 4-[2-[5,5-dimethyl-8-(5-methylthiophen-2-yl)-6H-naphthalen-2-yl]ethynyl]benzoate Openeye Name: ethyl 4-[2-[5,5-dimethyl-8-(5-methyl-2-thienyl)-6H-naphthalen-2-yl]ethynyl]benzoate CAS Name: 4-[2-[5,5-dimethyl-8-(5-methyl-2-thiophenyl)-6H-naphthalen-2-yl]ethynyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[5,5-dimethyl-8-(5-methylthiophen-2-yl)-6H-naphthalen-2-yl]ethynyl]benzoate Traditional Name: 4-[2-[5,5-dimethyl-8-(5-methyl-2-thienyl)-6H-naphthalen-2-yl]ethynyl]benzoic acid ethyl ester Formula: C28H26O2S MolecularWeight: 426.56984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C(CC=C3C4=CC=C(S4)C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C(CC=C3C4=CC=C(S4)C)(C)C

InChI

InChI=1S/C28H26O2S/c1-5-30-27(29)22-12-9-20(10-13-22)7-8-21-11-14-25-24(18-21)23(16-17-28(25,3)4)26-15-6-19(2)31-26/h6,9-16,18H,5,17H2,1-4H3