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

Systemtic Name: [2-azanyl-2-methyl-4-[5-(4-phenoxybutanoyl)thiophen-2-yl]butyl] dihydrogen phosphate Openeye Name: [2-amino-2-methyl-4-[5-(4-phenoxybutanoyl)-2-thienyl]butyl] dihydrogen phosphate CAS Name: [2-amino-2-methyl-4-[5-(1-oxo-4-phenoxybutyl)-2-thiophenyl]butyl] dihydrogen phosphate IUPAC Name: [2-amino-2-methyl-4-[5-(4-phenoxybutanoyl)thiophen-2-yl]butyl] dihydrogen phosphate Traditional Name: [2-amino-2-methyl-4-[5-(4-phenoxybutanoyl)-2-thienyl]butyl] dihydrogen phosphate Formula: C19H26NO6PS MolecularWeight: 427.451601

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C(=O)CCCOC2=CC=CC=C2)(COP(=O)(O)O)N

Isomeric SMILES

CC(CCC1=CC=C(S1)C(=O)CCCOC2=CC=CC=C2)(COP(=O)(O)O)N

InChI

InChI=1S/C19H26NO6PS/c1-19(20,14-26-27(22,23)24)12-11-16-9-10-18(28-16)17(21)8-5-13-25-15-6-3-2-4-7-15/h2-4,6-7,9-10H,5,8,11-14,20H2,1H3,(H2,22,23,24)