ethyl 4-[2-[4-(4-ethylphenyl)-2,2-dimethyl-chromen-6-yl]ethynyl]benzoate

Systemtic Name: ethyl 4-[2-[4-(4-ethylphenyl)-2,2-dimethyl-chromen-6-yl]ethynyl]benzoate Openeye Name: ethyl 4-[2-[4-(4-ethylphenyl)-2,2-dimethyl-chromen-6-yl]ethynyl]benzoate CAS Name: 4-[2-[4-(4-ethylphenyl)-2,2-dimethyl-1-benzopyran-6-yl]ethynyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-(4-ethylphenyl)-2,2-dimethylchromen-6-yl]ethynyl]benzoate Traditional Name: 4-[2-[4-(4-ethylphenyl)-2,2-dimethyl-chromen-6-yl]ethynyl]benzoic acid ethyl ester Formula: C30H28O3 MolecularWeight: 436.54152

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC(OC3=C2C=C(C=C3)C#CC4=CC=C(C=C4)C(=O)OCC)(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC(OC3=C2C=C(C=C3)C#CC4=CC=C(C=C4)C(=O)OCC)(C)C

InChI

InChI=1S/C30H28O3/c1-5-21-9-14-24(15-10-21)27-20-30(3,4)33-28-18-13-23(19-26(27)28)8-7-22-11-16-25(17-12-22)29(31)32-6-2/h9-20H,5-6H2,1-4H3