ethyl 3-[[1-cyclohexyl-5-(4-methylsulfonylphenyl)pyrazol-3-yl]methoxy]benzoate

Systemtic Name: ethyl 3-[[1-cyclohexyl-5-(4-methylsulfonylphenyl)pyrazol-3-yl]methoxy]benzoate Openeye Name: ethyl 3-[[1-cyclohexyl-5-(4-methylsulfonylphenyl)pyrazol-3-yl]methoxy]benzoate CAS Name: 3-[[1-cyclohexyl-5-(4-methylsulfonylphenyl)-3-pyrazolyl]methoxy]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[1-cyclohexyl-5-(4-methylsulfonylphenyl)pyrazol-3-yl]methoxy]benzoate Traditional Name: 3-[[1-cyclohexyl-5-(4-mesylphenyl)pyrazol-3-yl]methoxy]benzoic acid ethyl ester Formula: C26H30N2O5S MolecularWeight: 482.5918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)OCC2=NN(C(=C2)C3=CC=C(C=C3)S(=O)(=O)C)C4CCCCC4

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)OCC2=NN(C(=C2)C3=CC=C(C=C3)S(=O)(=O)C)C4CCCCC4

InChI

InChI=1S/C26H30N2O5S/c1-3-32-26(29)20-8-7-11-23(16-20)33-18-21-17-25(28(27-21)22-9-5-4-6-10-22)19-12-14-24(15-13-19)34(2,30)31/h7-8,11-17,22H,3-6,9-10,18H2,1-2H3