[2-azanyl-2-methyl-4-[5-(3-phenoxyprop-1-ynyl)thiophen-2-yl]butyl] dihydrogen phosphate

Systemtic Name: [2-azanyl-2-methyl-4-[5-(3-phenoxyprop-1-ynyl)thiophen-2-yl]butyl] dihydrogen phosphate Openeye Name: [2-amino-2-methyl-4-[5-(3-phenoxyprop-1-ynyl)-2-thienyl]butyl] dihydrogen phosphate CAS Name: [2-amino-2-methyl-4-[5-(3-phenoxyprop-1-ynyl)-2-thiophenyl]butyl] dihydrogen phosphate IUPAC Name: [2-amino-2-methyl-4-[5-(3-phenoxyprop-1-ynyl)thiophen-2-yl]butyl] dihydrogen phosphate Traditional Name: [2-amino-2-methyl-4-[5-(3-phenoxyprop-1-ynyl)-2-thienyl]butyl] dihydrogen phosphate Formula: C18H22NO5PS MolecularWeight: 395.409741

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C#CCOC2=CC=CC=C2)(COP(=O)(O)O)N

Isomeric SMILES

CC(CCC1=CC=C(S1)C#CCOC2=CC=CC=C2)(COP(=O)(O)O)N

InChI

InChI=1S/C18H22NO5PS/c1-18(19,14-24-25(20,21)22)12-11-17-10-9-16(26-17)8-5-13-23-15-6-3-2-4-7-15/h2-4,6-7,9-10H,11-14,19H2,1H3,(H2,20,21,22)