cyclohexyl (E)-5-(3-methylsulfonylphenyl)-3-oxidanylidene-pent-4-enoate

Systemtic Name: cyclohexyl (E)-5-(3-methylsulfonylphenyl)-3-oxidanylidene-pent-4-enoate Openeye Name: cyclohexyl (E)-5-(3-methylsulfonylphenyl)-3-oxo-pent-4-enoate CAS Name: (E)-5-(3-methylsulfonylphenyl)-3-oxo-4-pentenoic acid cyclohexyl ester IUPAC Name: cyclohexyl (E)-5-(3-methylsulfonylphenyl)-3-oxopent-4-enoate Traditional Name: (E)-3-keto-5-(3-mesylphenyl)pent-4-enoic acid cyclohexyl ester Formula: C18H22O5S MolecularWeight: 350.42928

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C=CC(=O)CC(=O)OC2CCCCC2

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)/C=C/C(=O)CC(=O)OC2CCCCC2

InChI

InChI=1S/C18H22O5S/c1-24(21,22)17-9-5-6-14(12-17)10-11-15(19)13-18(20)23-16-7-3-2-4-8-16/h5-6,9-12,16H,2-4,7-8,13H2,1H3/b11-10+