methyl 4-cyclohexyl-3-(phenylsulfonyl)butanoate

Systemtic Name: methyl 4-cyclohexyl-3-(phenylsulfonyl)butanoate Openeye Name: methyl 3-(benzenesulfonyl)-4-cyclohexyl-butanoate CAS Name: 3-(benzenesulfonyl)-4-cyclohexylbutanoic acid methyl ester IUPAC Name: methyl 3-(benzenesulfonyl)-4-cyclohexylbutanoate Traditional Name: 3-besyl-4-cyclohexyl-butyric acid methyl ester Formula: C17H24O4S MolecularWeight: 324.43506

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC1CCCCC1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CC(CC1CCCCC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H24O4S/c1-21-17(18)13-16(12-14-8-4-2-5-9-14)22(19,20)15-10-6-3-7-11-15/h3,6-7,10-11,14,16H,2,4-5,8-9,12-13H2,1H3