[2-azanyl-4-[5-(6-cyclohexylhex-1-ynyl)thiophen-2-yl]-2-ethyl-butyl] dihydrogen phosphate

Systemtic Name: [2-azanyl-4-[5-(6-cyclohexylhex-1-ynyl)thiophen-2-yl]-2-ethyl-butyl] dihydrogen phosphate Openeye Name: [2-amino-4-[5-(6-cyclohexylhex-1-ynyl)-2-thienyl]-2-ethyl-butyl] dihydrogen phosphate CAS Name: [2-amino-4-[5-(6-cyclohexylhex-1-ynyl)-2-thiophenyl]-2-ethylbutyl] dihydrogen phosphate IUPAC Name: [2-amino-4-[5-(6-cyclohexylhex-1-ynyl)thiophen-2-yl]-2-ethylbutyl] dihydrogen phosphate Traditional Name: [2-amino-4-[5-(6-cyclohexylhex-1-ynyl)-2-thienyl]-2-ethyl-butyl] dihydrogen phosphate Formula: C22H36NO4PS MolecularWeight: 441.564301

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC=C(S1)C#CCCCCC2CCCCC2)(COP(=O)(O)O)N

Isomeric SMILES

CCC(CCC1=CC=C(S1)C#CCCCCC2CCCCC2)(COP(=O)(O)O)N

InChI

InChI=1S/C22H36NO4PS/c1-2-22(23,18-27-28(24,25)26)17-16-21-15-14-20(29-21)13-9-4-3-6-10-19-11-7-5-8-12-19/h14-15,19H,2-8,10-12,16-18,23H2,1H3,(H2,24,25,26)