2-[1-(4-aminophenyl)-2-sulfooxy-ethyl]sulfonylethyl hydrogen sulfate

Systemtic Name: 2-[1-(4-aminophenyl)-2-sulfooxy-ethyl]sulfonylethyl hydrogen sulfate Openeye Name: 2-[1-(4-aminophenyl)-2-sulfooxy-ethyl]sulfonylethyl hydrogen sulfate CAS Name: sulfuric acid 2-[1-(4-aminophenyl)-2-sulfooxyethyl]sulfonylethyl ester IUPAC Name: 2-[1-(4-aminophenyl)-2-sulfooxyethyl]sulfonylethyl hydrogen sulfate Traditional Name: sulfuric acid 2-[1-(4-aminophenyl)-2-sulfoxy-ethyl]sulfonylethyl ester Formula: C10H15NO10S3 MolecularWeight: 405.4218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(COS(=O)(=O)O)S(=O)(=O)CCOS(=O)(=O)O)N

Isomeric SMILES

C1=CC(=CC=C1C(COS(=O)(=O)O)S(=O)(=O)CCOS(=O)(=O)O)N

InChI

InChI=1S/C10H15NO10S3/c11-9-3-1-8(2-4-9)10(7-21-24(17,18)19)22(12,13)6-5-20-23(14,15)16/h1-4,10H,5-7,11H2,(H,14,15,16)(H,17,18,19)