butan-2-yloxysulfinyloxy-but-1-ynyl-ethanoyl-phenyl-azanium

Systemtic Name: butan-2-yloxysulfinyloxy-but-1-ynyl-ethanoyl-phenyl-azanium Openeye Name: acetyl-but-1-ynyl-phenyl-sec-butoxysulfinyloxy-ammonium CAS Name: acetyl-butan-2-yloxysulfinyloxy-but-1-ynyl-phenylammonium IUPAC Name: acetyl-butan-2-yloxysulfinyloxy-but-1-ynyl-phenylazanium Traditional Name: acetyl-but-1-ynyl-phenyl-sec-butoxysulfinyloxy-ammonium Formula: C16H22NO4S+ MolecularWeight: 324.41518

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Descriptors Computed from Structure

Canonical SMILES:

CCC#C[N+](C1=CC=CC=C1)(C(=O)C)OS(=O)OC(C)CC

Isomeric SMILES

CCC#C[N+](C1=CC=CC=C1)(C(=O)C)OS(=O)OC(C)CC

InChI

InChI=1S/C16H22NO4S/c1-5-7-13-17(15(4)18,16-11-9-8-10-12-16)21-22(19)20-14(3)6-2/h8-12,14H,5-6H2,1-4H3/q+1