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

Systemtic Name: [(2R)-2-azanyl-2-methyl-4-[1-methyl-5-(5-phenylpentanoyl)pyrrol-2-yl]butyl] dihydrogen phosphate Openeye Name: [(2R)-2-amino-2-methyl-4-[1-methyl-5-(5-phenylpentanoyl)pyrrol-2-yl]butyl] dihydrogen phosphate CAS Name: [(2R)-2-amino-2-methyl-4-[1-methyl-5-(1-oxo-5-phenylpentyl)-2-pyrrolyl]butyl] dihydrogen phosphate IUPAC Name: [(2R)-2-amino-2-methyl-4-[1-methyl-5-(5-phenylpentanoyl)pyrrol-2-yl]butyl] dihydrogen phosphate Traditional Name: [(2R)-2-amino-2-methyl-4-[1-methyl-5-(5-phenylpentanoyl)pyrrol-2-yl]butyl] dihydrogen phosphate Formula: C21H31N2O5P MolecularWeight: 422.455001

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(N1C)C(=O)CCCCC2=CC=CC=C2)(COP(=O)(O)O)N

Isomeric SMILES

C[C@@](CCC1=CC=C(N1C)C(=O)CCCCC2=CC=CC=C2)(COP(=O)(O)O)N

InChI

InChI=1S/C21H31N2O5P/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/h3-5,8-9,12-13H,6-7,10-11,14-16,22H2,1-2H3,(H2,25,26,27)/t21-/m1/s1