(5-azanyl-4-ethyl-3-methylsulfonyl-2-methylsulfonyloxysulfinyl-naphthalen-1-yl) methanesulfonate

Systemtic Name: (5-azanyl-4-ethyl-3-methylsulfonyl-2-methylsulfonyloxysulfinyl-naphthalen-1-yl) methanesulfonate Openeye Name: (5-amino-4-ethyl-3-methylsulfonyl-2-methylsulfonyloxysulfinyl-1-naphthyl) methanesulfonate CAS Name: methanesulfonic acid (5-amino-4-ethyl-3-methylsulfonyl-2-methylsulfonyloxysulfinyl-1-naphthalenyl) ester IUPAC Name: (5-amino-4-ethyl-3-methylsulfonyl-2-methylsulfonyloxysulfinylnaphthalen-1-yl) methanesulfonate Traditional Name: methanesulfonic acid (5-amino-4-ethyl-3-mesyl-2-methylsulfonyloxysulfinyl-1-naphthyl) ester Formula: C15H19NO9S4 MolecularWeight: 485.57266

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C2=C1C(=CC=C2)N)OS(=O)(=O)C)S(=O)OS(=O)(=O)C)S(=O)(=O)C

Isomeric SMILES

CCC1=C(C(=C(C2=C1C(=CC=C2)N)OS(=O)(=O)C)S(=O)OS(=O)(=O)C)S(=O)(=O)C

InChI

InChI=1S/C15H19NO9S4/c1-5-9-12-10(7-6-8-11(12)16)13(24-28(3,20)21)14(15(9)27(2,18)19)26(17)25-29(4,22)23/h6-8H,5,16H2,1-4H3