[5-(4,4-diethyl-7-hexyl-2,3-dihydrochromen-6-yl)furan-2-yl] 2-ethylbut-3-ynoate

Systemtic Name: [5-(4,4-diethyl-7-hexyl-2,3-dihydrochromen-6-yl)furan-2-yl] 2-ethylbut-3-ynoate Openeye Name: [5-(4,4-diethyl-7-hexyl-chroman-6-yl)-2-furyl] 2-ethylbut-3-ynoate CAS Name: 2-ethyl-3-butynoic acid [5-(4,4-diethyl-7-hexyl-3,4-dihydro-2H-1-benzopyran-6-yl)-2-furanyl] ester IUPAC Name: [5-(4,4-diethyl-7-hexyl-2,3-dihydrochromen-6-yl)furan-2-yl] 2-ethylbut-3-ynoate Traditional Name: 2-ethylbut-3-ynoic acid [5-(4,4-diethyl-7-hexyl-chroman-6-yl)-2-furyl] ester Formula: C29H38O4 MolecularWeight: 450.60962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(C=C1C3=CC=C(O3)OC(=O)C(CC)C#C)C(CCO2)(CC)CC

Isomeric SMILES

CCCCCCC1=CC2=C(C=C1C3=CC=C(O3)OC(=O)C(CC)C#C)C(CCO2)(CC)CC

InChI

InChI=1S/C29H38O4/c1-6-11-12-13-14-22-19-26-24(29(9-4,10-5)17-18-31-26)20-23(22)25-15-16-27(32-25)33-28(30)21(7-2)8-3/h2,15-16,19-21H,6,8-14,17-18H2,1,3-5H3