[5-[[3-(cyclopentylmethoxy)-5-propan-2-yloxy-phenyl]carbonylamino]pyrazin-2-yl]-methyl-phosphinic acid

Systemtic Name: [5-[[3-(cyclopentylmethoxy)-5-propan-2-yloxy-phenyl]carbonylamino]pyrazin-2-yl]-methyl-phosphinic acid Openeye Name: [5-[[3-(cyclopentylmethoxy)-5-isopropoxy-benzoyl]amino]pyrazin-2-yl]-methyl-phosphinic acid CAS Name: [5-[[[3-(cyclopentylmethoxy)-5-propan-2-yloxyphenyl]-oxomethyl]amino]-2-pyrazinyl]-methylphosphinic acid IUPAC Name: [5-[[3-(cyclopentylmethoxy)-5-propan-2-yloxybenzoyl]amino]pyrazin-2-yl]-methylphosphinic acid Traditional Name: [5-[[3-(cyclopentylmethoxy)-5-isopropoxy-benzoyl]amino]pyrazin-2-yl]-methyl-phosphinic acid Formula: C21H28N3O5P MolecularWeight: 433.437881

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=CC(=C1)OCC2CCCC2)C(=O)NC3=CN=C(C=N3)P(=O)(C)O

Isomeric SMILES

CC(C)OC1=CC(=CC(=C1)OCC2CCCC2)C(=O)NC3=CN=C(C=N3)P(=O)(C)O

InChI

InChI=1S/C21H28N3O5P/c1-14(2)29-18-9-16(8-17(10-18)28-13-15-6-4-5-7-15)21(25)24-19-11-23-20(12-22-19)30(3,26)27/h8-12,14-15H,4-7,13H2,1-3H3,(H,26,27)(H,22,24,25)