4-(3-chloranyl-4-propan-2-yl-phenyl)-2-ethyl-2-methyl-5-(4-methylsulfonylphenyl)furan-3-one

Systemtic Name: 4-(3-chloranyl-4-propan-2-yl-phenyl)-2-ethyl-2-methyl-5-(4-methylsulfonylphenyl)furan-3-one Openeye Name: 4-(3-chloro-4-isopropyl-phenyl)-2-ethyl-2-methyl-5-(4-methylsulfonylphenyl)furan-3-one CAS Name: 4-(3-chloro-4-propan-2-ylphenyl)-2-ethyl-2-methyl-5-(4-methylsulfonylphenyl)-3-furanone IUPAC Name: 4-(3-chloro-4-propan-2-ylphenyl)-2-ethyl-2-methyl-5-(4-methylsulfonylphenyl)furan-3-one Traditional Name: 4-(3-chloro-4-isopropyl-phenyl)-2-ethyl-5-(4-mesylphenyl)-2-methyl-furan-3-one Formula: C23H25ClO4S MolecularWeight: 432.9602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC(=C(C=C3)C(C)C)Cl)C

Isomeric SMILES

CCC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC(=C(C=C3)C(C)C)Cl)C

InChI

InChI=1S/C23H25ClO4S/c1-6-23(4)22(25)20(16-9-12-18(14(2)3)19(24)13-16)21(28-23)15-7-10-17(11-8-15)29(5,26)27/h7-14H,6H2,1-5H3