[(2R)-2-azanyl-2-ethyl-4-[5-(5-phenylpentanoyl)thiophen-2-yl]butyl] dihydrogen phosphate

Systemtic Name: [(2R)-2-azanyl-2-ethyl-4-[5-(5-phenylpentanoyl)thiophen-2-yl]butyl] dihydrogen phosphate Openeye Name: [(2R)-2-amino-2-ethyl-4-[5-(5-phenylpentanoyl)-2-thienyl]butyl] dihydrogen phosphate CAS Name: [(2R)-2-amino-2-ethyl-4-[5-(1-oxo-5-phenylpentyl)-2-thiophenyl]butyl] dihydrogen phosphate IUPAC Name: [(2R)-2-amino-2-ethyl-4-[5-(5-phenylpentanoyl)thiophen-2-yl]butyl] dihydrogen phosphate Traditional Name: [(2R)-2-amino-2-ethyl-4-[5-(5-phenylpentanoyl)-2-thienyl]butyl] dihydrogen phosphate Formula: C21H30NO5PS MolecularWeight: 439.505361

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC=C(S1)C(=O)CCCCC2=CC=CC=C2)(COP(=O)(O)O)N

Isomeric SMILES

CC[C@@](CCC1=CC=C(S1)C(=O)CCCCC2=CC=CC=C2)(COP(=O)(O)O)N

InChI

InChI=1S/C21H30NO5PS/c1-2-21(22,16-27-28(24,25)26)15-14-18-12-13-20(29-18)19(23)11-7-6-10-17-8-4-3-5-9-17/h3-5,8-9,12-13H,2,6-7,10-11,14-16,22H2,1H3,(H2,24,25,26)/t21-/m1/s1