2-(6-azanylnaphthalen-2-yl)sulfonylethyl hydrogen sulfate

Systemtic Name: 2-(6-azanylnaphthalen-2-yl)sulfonylethyl hydrogen sulfate Openeye Name: 2-[(6-amino-2-naphthyl)sulfonyl]ethyl hydrogen sulfate CAS Name: sulfuric acid 2-[(6-amino-2-naphthalenyl)sulfonyl]ethyl ester IUPAC Name: 2-(6-aminonaphthalen-2-yl)sulfonylethyl hydrogen sulfate Traditional Name: sulfuric acid 2-[(6-amino-2-naphthyl)sulfonyl]ethyl ester Formula: C12H13NO6S2 MolecularWeight: 331.36472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)S(=O)(=O)CCOS(=O)(=O)O)C=C1N

Isomeric SMILES

C1=CC2=C(C=CC(=C2)S(=O)(=O)CCOS(=O)(=O)O)C=C1N

InChI

InChI=1S/C12H13NO6S2/c13-11-3-1-10-8-12(4-2-9(10)7-11)20(14,15)6-5-19-21(16,17)18/h1-4,7-8H,5-6,13H2,(H,16,17,18)