[4-cyclohexyl-2-[(E)-2-(4-methoxyphenyl)ethenyl]-6-oxidanylidene-pyridin-1-yl] methanesulfonate

Systemtic Name: [4-cyclohexyl-2-[(E)-2-(4-methoxyphenyl)ethenyl]-6-oxidanylidene-pyridin-1-yl] methanesulfonate Openeye Name: [4-cyclohexyl-2-[(E)-2-(4-methoxyphenyl)vinyl]-6-oxo-1-pyridyl] methanesulfonate CAS Name: methanesulfonic acid [4-cyclohexyl-2-[(E)-2-(4-methoxyphenyl)ethenyl]-6-oxo-1-pyridinyl] ester IUPAC Name: [4-cyclohexyl-2-[(E)-2-(4-methoxyphenyl)ethenyl]-6-oxopyridin-1-yl] methanesulfonate Traditional Name: methanesulfonic acid [4-cyclohexyl-2-keto-6-[(E)-2-(4-methoxyphenyl)vinyl]-1-pyridyl] ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC2=CC(=CC(=O)N2OS(=O)(=O)C)C3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C2=CC(=CC(=O)N2OS(=O)(=O)C)C3CCCCC3

InChI

InChI=1S/C21H25NO5S/c1-26-20-12-9-16(10-13-20)8-11-19-14-18(17-6-4-3-5-7-17)15-21(23)22(19)27-28(2,24)25/h8-15,17H,3-7H2,1-2H3/b11-8+