[2-azanyl-2-methyl-4-[5-(4-phenylmethoxybut-1-ynyl)thiophen-2-yl]butyl] dihydrogen phosphate

Systemtic Name: [2-azanyl-2-methyl-4-[5-(4-phenylmethoxybut-1-ynyl)thiophen-2-yl]butyl] dihydrogen phosphate Openeye Name: [2-amino-4-[5-(4-benzyloxybut-1-ynyl)-2-thienyl]-2-methyl-butyl] dihydrogen phosphate CAS Name: [2-amino-2-methyl-4-[5-(4-phenylmethoxybut-1-ynyl)-2-thiophenyl]butyl] dihydrogen phosphate IUPAC Name: [2-amino-2-methyl-4-[5-(4-phenylmethoxybut-1-ynyl)thiophen-2-yl]butyl] dihydrogen phosphate Traditional Name: [2-amino-4-[5-(4-benzoxybut-1-ynyl)-2-thienyl]-2-methyl-butyl] dihydrogen phosphate Formula: C20H26NO5PS MolecularWeight: 423.462901

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C#CCCOCC2=CC=CC=C2)(COP(=O)(O)O)N

Isomeric SMILES

CC(CCC1=CC=C(S1)C#CCCOCC2=CC=CC=C2)(COP(=O)(O)O)N

InChI

InChI=1S/C20H26NO5PS/c1-20(21,16-26-27(22,23)24)13-12-19-11-10-18(28-19)9-5-6-14-25-15-17-7-3-2-4-8-17/h2-4,7-8,10-11H,6,12-16,21H2,1H3,(H2,22,23,24)