[2-azanyl-4-[5-(5-cyclohexylpentanoyl)-1-ethyl-pyrrol-2-yl]-2-methyl-butyl] dihydrogen phosphate

Systemtic Name: [2-azanyl-4-[5-(5-cyclohexylpentanoyl)-1-ethyl-pyrrol-2-yl]-2-methyl-butyl] dihydrogen phosphate Openeye Name: [2-amino-4-[5-(5-cyclohexylpentanoyl)-1-ethyl-pyrrol-2-yl]-2-methyl-butyl] dihydrogen phosphate CAS Name: [2-amino-4-[5-(5-cyclohexyl-1-oxopentyl)-1-ethyl-2-pyrrolyl]-2-methylbutyl] dihydrogen phosphate IUPAC Name: [2-amino-4-[5-(5-cyclohexylpentanoyl)-1-ethylpyrrol-2-yl]-2-methylbutyl] dihydrogen phosphate Traditional Name: [2-amino-4-[5-(5-cyclohexylpentanoyl)-1-ethyl-pyrrol-2-yl]-2-methyl-butyl] dihydrogen phosphate Formula: C22H39N2O5P MolecularWeight: 442.529221

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=C1C(=O)CCCCC2CCCCC2)CCC(C)(COP(=O)(O)O)N

Isomeric SMILES

CCN1C(=CC=C1C(=O)CCCCC2CCCCC2)CCC(C)(COP(=O)(O)O)N

InChI

InChI=1S/C22H39N2O5P/c1-3-24-19(15-16-22(2,23)17-29-30(26,27)28)13-14-20(24)21(25)12-8-7-11-18-9-5-4-6-10-18/h13-14,18H,3-12,15-17,23H2,1-2H3,(H2,26,27,28)