propan-2-yl (E)-7-(5-heptyl-5-oxidanyl-2-oxidanylidene-3,3a,4,6,7,7a-hexahydro-1H-inden-1-yl)hept-5-enoate

Systemtic Name: propan-2-yl (E)-7-(5-heptyl-5-oxidanyl-2-oxidanylidene-3,3a,4,6,7,7a-hexahydro-1H-inden-1-yl)hept-5-enoate Openeye Name: isopropyl (E)-7-(5-heptyl-5-hydroxy-2-oxo-3,3a,4,6,7,7a-hexahydro-1H-inden-1-yl)hept-5-enoate CAS Name: (E)-7-(5-heptyl-5-hydroxy-2-oxo-3,3a,4,6,7,7a-hexahydro-1H-inden-1-yl)-5-heptenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-7-(5-heptyl-5-hydroxy-2-oxo-3,3a,4,6,7,7a-hexahydro-1H-inden-1-yl)hept-5-enoate Traditional Name: (E)-7-(5-heptyl-5-hydroxy-2-keto-3,3a,4,6,7,7a-hexahydro-1H-inden-1-yl)hept-5-enoic acid isopropyl ester Formula: C26H44O4 MolecularWeight: 420.62516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(CCC2C(C1)CC(=O)C2CC=CCCCC(=O)OC(C)C)O

Isomeric SMILES

CCCCCCCC1(CCC2C(C1)CC(=O)C2C/C=C/CCCC(=O)OC(C)C)O

InChI

InChI=1S/C26H44O4/c1-4-5-6-9-12-16-26(29)17-15-22-21(19-26)18-24(27)23(22)13-10-7-8-11-14-25(28)30-20(2)3/h7,10,20-23,29H,4-6,8-9,11-19H2,1-3H3/b10-7+