[2-azanyl-2-methyl-4-[5-(5-phenoxypentanoyl)thiophen-2-yl]butyl] dihydrogen phosphate

Systemtic Name: [2-azanyl-2-methyl-4-[5-(5-phenoxypentanoyl)thiophen-2-yl]butyl] dihydrogen phosphate Openeye Name: [2-amino-2-methyl-4-[5-(5-phenoxypentanoyl)-2-thienyl]butyl] dihydrogen phosphate CAS Name: [2-amino-2-methyl-4-[5-(1-oxo-5-phenoxypentyl)-2-thiophenyl]butyl] dihydrogen phosphate IUPAC Name: [2-amino-2-methyl-4-[5-(5-phenoxypentanoyl)thiophen-2-yl]butyl] dihydrogen phosphate Traditional Name: [2-amino-2-methyl-4-[5-(5-phenoxypentanoyl)-2-thienyl]butyl] dihydrogen phosphate Formula: C20H28NO6PS MolecularWeight: 441.478181

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C(=O)CCCCOC2=CC=CC=C2)(COP(=O)(O)O)N

Isomeric SMILES

CC(CCC1=CC=C(S1)C(=O)CCCCOC2=CC=CC=C2)(COP(=O)(O)O)N

InChI

InChI=1S/C20H28NO6PS/c1-20(21,15-27-28(23,24)25)13-12-17-10-11-19(29-17)18(22)9-5-6-14-26-16-7-3-2-4-8-16/h2-4,7-8,10-11H,5-6,9,12-15,21H2,1H3,(H2,23,24,25)