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

Systemtic Name: [2-azanyl-4-[5-(5-cyclohexylpentanoyl)-1-methyl-pyrrol-2-yl]-2-methyl-butyl] dihydrogen phosphate Openeye Name: [2-amino-4-[5-(5-cyclohexylpentanoyl)-1-methyl-pyrrol-2-yl]-2-methyl-butyl] dihydrogen phosphate CAS Name: [2-amino-4-[5-(5-cyclohexyl-1-oxopentyl)-1-methyl-2-pyrrolyl]-2-methylbutyl] dihydrogen phosphate IUPAC Name: [2-amino-4-[5-(5-cyclohexylpentanoyl)-1-methylpyrrol-2-yl]-2-methylbutyl] dihydrogen phosphate Traditional Name: [2-amino-4-[5-(5-cyclohexylpentanoyl)-1-methyl-pyrrol-2-yl]-2-methyl-butyl] dihydrogen phosphate Formula: C21H37N2O5P MolecularWeight: 428.502641

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(N1C)C(=O)CCCCC2CCCCC2)(COP(=O)(O)O)N

Isomeric SMILES

CC(CCC1=CC=C(N1C)C(=O)CCCCC2CCCCC2)(COP(=O)(O)O)N

InChI

InChI=1S/C21H37N2O5P/c1-21(22,16-28-29(25,26)27)15-14-18-12-13-19(23(18)2)20(24)11-7-6-10-17-8-4-3-5-9-17/h12-13,17H,3-11,14-16,22H2,1-2H3,(H2,25,26,27)