cyclohexyl 1-diethoxyphosphoryl-4-(3-phenoxyphenyl)butane-1-sulfonate

Systemtic Name: cyclohexyl 1-diethoxyphosphoryl-4-(3-phenoxyphenyl)butane-1-sulfonate Openeye Name: cyclohexyl 1-diethoxyphosphoryl-4-(3-phenoxyphenyl)butane-1-sulfonate CAS Name: 1-diethoxyphosphoryl-4-(3-phenoxyphenyl)-1-butanesulfonic acid IUPAC Name: cyclohexyl 1-diethoxyphosphoryl-4-(3-phenoxyphenyl)butane-1-sulfonate Traditional Name: 1-diethoxyphosphoryl-4-(3-phenoxyphenyl)butane-1-sulfonic acid cyclohexyl ester Formula: C26H37O7PS MolecularWeight: 524.606541

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CCCC1=CC(=CC=C1)OC2=CC=CC=C2)S(=O)(=O)OC3CCCCC3)OCC

Isomeric SMILES

CCOP(=O)(C(CCCC1=CC(=CC=C1)OC2=CC=CC=C2)S(=O)(=O)OC3CCCCC3)OCC

InChI

InChI=1S/C26H37O7PS/c1-3-30-34(27,31-4-2)26(35(28,29)33-24-17-9-6-10-18-24)20-12-14-22-13-11-19-25(21-22)32-23-15-7-5-8-16-23/h5,7-8,11,13,15-16,19,21,24,26H,3-4,6,9-10,12,14,17-18,20H2,1-2H3