[2-(3-chlorophenyl)-3a-ethyl-8b-oxidanyl-4-oxidanylidene-3H-indeno[1,2-b]furan-2-yl]methyl hexanoate

Systemtic Name: [2-(3-chlorophenyl)-3a-ethyl-8b-oxidanyl-4-oxidanylidene-3H-indeno[1,2-b]furan-2-yl]methyl hexanoate Openeye Name: [2-(3-chlorophenyl)-3a-ethyl-8b-hydroxy-4-oxo-3H-indeno[1,2-b]furan-2-yl]methyl hexanoate CAS Name: hexanoic acid [2-(3-chlorophenyl)-3a-ethyl-8b-hydroxy-4-oxo-3H-indeno[1,2-b]furan-2-yl]methyl ester IUPAC Name: [2-(3-chlorophenyl)-3a-ethyl-8b-hydroxy-4-oxo-3H-indeno[1,2-b]furan-2-yl]methyl hexanoate Traditional Name: hexanoic acid [2-(3-chlorophenyl)-3a-ethyl-8b-hydroxy-4-keto-3H-indeno[1,2-b]furan-2-yl]methyl ester Formula: C26H29ClO5 MolecularWeight: 456.95846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCC1(CC2(C(=O)C3=CC=CC=C3C2(O1)O)CC)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCCCCC(=O)OCC1(CC2(C(=O)C3=CC=CC=C3C2(O1)O)CC)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H29ClO5/c1-3-5-6-14-22(28)31-17-25(18-10-9-11-19(27)15-18)16-24(4-2)23(29)20-12-7-8-13-21(20)26(24,30)32-25/h7-13,15,30H,3-6,14,16-17H2,1-2H3