ethyl 5-[5-[2-(4,4-diethyl-7-methyl-2,3-dihydrochromen-6-yl)ethynyl]pyrazin-2-yl]pentanoate

Systemtic Name: ethyl 5-[5-[2-(4,4-diethyl-7-methyl-2,3-dihydrochromen-6-yl)ethynyl]pyrazin-2-yl]pentanoate Openeye Name: ethyl 5-[5-[2-(4,4-diethyl-7-methyl-chroman-6-yl)ethynyl]pyrazin-2-yl]pentanoate CAS Name: 5-[5-[2-(4,4-diethyl-7-methyl-3,4-dihydro-2H-1-benzopyran-6-yl)ethynyl]-2-pyrazinyl]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[5-[2-(4,4-diethyl-7-methyl-2,3-dihydrochromen-6-yl)ethynyl]pyrazin-2-yl]pentanoate Traditional Name: 5-[5-[2-(4,4-diethyl-7-methyl-chroman-6-yl)ethynyl]pyrazin-2-yl]valeric acid ethyl ester Formula: C27H34N2O3 MolecularWeight: 434.57046

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCOC2=C1C=C(C(=C2)C)C#CC3=CN=C(C=N3)CCCCC(=O)OCC)CC

Isomeric SMILES

CCC1(CCOC2=C1C=C(C(=C2)C)C#CC3=CN=C(C=N3)CCCCC(=O)OCC)CC

InChI

InChI=1S/C27H34N2O3/c1-5-27(6-2)14-15-32-25-16-20(4)21(17-24(25)27)12-13-23-19-28-22(18-29-23)10-8-9-11-26(30)31-7-3/h16-19H,5-11,14-15H2,1-4H3