6-[2-(3-chloranyl-4-propan-2-yl-phenyl)ethyl]-6-cyclopentyl-oxane-2,4-dione

Systemtic Name: 6-[2-(3-chloranyl-4-propan-2-yl-phenyl)ethyl]-6-cyclopentyl-oxane-2,4-dione Openeye Name: 6-[2-(3-chloro-4-isopropyl-phenyl)ethyl]-6-cyclopentyl-tetrahydropyran-2,4-dione CAS Name: 6-[2-(3-chloro-4-propan-2-ylphenyl)ethyl]-6-cyclopentyloxane-2,4-dione IUPAC Name: 6-[2-(3-chloro-4-propan-2-ylphenyl)ethyl]-6-cyclopentyloxane-2,4-dione Traditional Name: 6-[2-(3-chloro-4-isopropyl-phenyl)ethyl]-6-cyclopentyl-tetrahydropyran-2,4-quinone Formula: C21H27ClO3 MolecularWeight: 362.89028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)CCC2(CC(=O)CC(=O)O2)C3CCCC3)Cl

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)CCC2(CC(=O)CC(=O)O2)C3CCCC3)Cl

InChI

InChI=1S/C21H27ClO3/c1-14(2)18-8-7-15(11-19(18)22)9-10-21(16-5-3-4-6-16)13-17(23)12-20(24)25-21/h7-8,11,14,16H,3-6,9-10,12-13H2,1-2H3