pyridin-3-yl 4-(4,4-diethyl-2,3-dihydrochromen-6-yl)-2-ethyl-but-3-ynoate

Systemtic Name: pyridin-3-yl 4-(4,4-diethyl-2,3-dihydrochromen-6-yl)-2-ethyl-but-3-ynoate Openeye Name: 3-pyridyl 4-(4,4-diethylchroman-6-yl)-2-ethyl-but-3-ynoate CAS Name: 4-(4,4-diethyl-3,4-dihydro-2H-1-benzopyran-6-yl)-2-ethyl-3-butynoic acid 3-pyridinyl ester IUPAC Name: pyridin-3-yl 4-(4,4-diethyl-2,3-dihydrochromen-6-yl)-2-ethylbut-3-ynoate Traditional Name: 4-(4,4-diethylchroman-6-yl)-2-ethyl-but-3-ynoic acid 3-pyridyl ester Formula: C24H27NO3 MolecularWeight: 377.47608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C#CC1=CC2=C(C=C1)OCCC2(CC)CC)C(=O)OC3=CN=CC=C3

Isomeric SMILES

CCC(C#CC1=CC2=C(C=C1)OCCC2(CC)CC)C(=O)OC3=CN=CC=C3

InChI

InChI=1S/C24H27NO3/c1-4-19(23(26)28-20-8-7-14-25-17-20)11-9-18-10-12-22-21(16-18)24(5-2,6-3)13-15-27-22/h7-8,10,12,14,16-17,19H,4-6,13,15H2,1-3H3