[1-cyclohexyloxysulfonyl-4-(3-phenoxyphenyl)butyl]phosphonic acid

Systemtic Name: [1-cyclohexyloxysulfonyl-4-(3-phenoxyphenyl)butyl]phosphonic acid Openeye Name: [1-(cyclohexoxysulfonyl)-4-(3-phenoxyphenyl)butyl]phosphonic acid CAS Name: [1-cyclohexyloxysulfonyl-4-(3-phenoxyphenyl)butyl]phosphonic acid IUPAC Name: [1-cyclohexyloxysulfonyl-4-(3-phenoxyphenyl)butyl]phosphonic acid Traditional Name: [1-(cyclohexoxysulfonyl)-4-(3-phenoxyphenyl)butyl]phosphonic acid Formula: C22H29O7PS MolecularWeight: 468.500221

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OS(=O)(=O)C(CCCC2=CC(=CC=C2)OC3=CC=CC=C3)P(=O)(O)O

Isomeric SMILES

C1CCC(CC1)OS(=O)(=O)C(CCCC2=CC(=CC=C2)OC3=CC=CC=C3)P(=O)(O)O

InChI

InChI=1S/C22H29O7PS/c23-30(24,25)22(31(26,27)29-20-13-5-2-6-14-20)16-8-10-18-9-7-15-21(17-18)28-19-11-3-1-4-12-19/h1,3-4,7,9,11-12,15,17,20,22H,2,5-6,8,10,13-14,16H2,(H2,23,24,25)