propan-2-yl 7-[2-(4-tert-butylphenyl)-5-chloranyl-3-oxidanyl-cyclopentyl]heptanoate

Systemtic Name: propan-2-yl 7-[2-(4-tert-butylphenyl)-5-chloranyl-3-oxidanyl-cyclopentyl]heptanoate Openeye Name: isopropyl 7-[2-(4-tert-butylphenyl)-5-chloro-3-hydroxy-cyclopentyl]heptanoate CAS Name: 7-[2-(4-tert-butylphenyl)-5-chloro-3-hydroxycyclopentyl]heptanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 7-[2-(4-tert-butylphenyl)-5-chloro-3-hydroxycyclopentyl]heptanoate Traditional Name: 7-[2-(4-tert-butylphenyl)-5-chloro-3-hydroxy-cyclopentyl]enanthic acid isopropyl ester Formula: C25H39ClO3 MolecularWeight: 423.02836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CCCCCCC1C(CC(C1C2=CC=C(C=C2)C(C)(C)C)O)Cl

Isomeric SMILES

CC(C)OC(=O)CCCCCCC1C(CC(C1C2=CC=C(C=C2)C(C)(C)C)O)Cl

InChI

InChI=1S/C25H39ClO3/c1-17(2)29-23(28)11-9-7-6-8-10-20-21(26)16-22(27)24(20)18-12-14-19(15-13-18)25(3,4)5/h12-15,17,20-22,24,27H,6-11,16H2,1-5H3