4-[5-(4-cyclohexyloxybut-1-ynyl)-1-methyl-pyrrol-2-yl]butyl dihydrogen phosphate

Systemtic Name: 4-[5-(4-cyclohexyloxybut-1-ynyl)-1-methyl-pyrrol-2-yl]butyl dihydrogen phosphate Openeye Name: 4-[5-[4-(cyclohexoxy)but-1-ynyl]-1-methyl-pyrrol-2-yl]butyl dihydrogen phosphate CAS Name: 4-[5-(4-cyclohexyloxybut-1-ynyl)-1-methyl-2-pyrrolyl]butyl dihydrogen phosphate IUPAC Name: 4-[5-(4-cyclohexyloxybut-1-ynyl)-1-methylpyrrol-2-yl]butyl dihydrogen phosphate Traditional Name: 4-[5-[4-(cyclohexoxy)but-1-ynyl]-1-methyl-pyrrol-2-yl]butyl dihydrogen phosphate Formula: C19H30NO5P MolecularWeight: 383.418961

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C#CCCOC2CCCCC2)CCCCOP(=O)(O)O

Isomeric SMILES

CN1C(=CC=C1C#CCCOC2CCCCC2)CCCCOP(=O)(O)O

InChI

InChI=1S/C19H30NO5P/c1-20-17(9-5-7-15-24-19-11-3-2-4-12-19)13-14-18(20)10-6-8-16-25-26(21,22)23/h13-14,19H,2-4,6-8,10-12,15-16H2,1H3,(H2,21,22,23)