[2-(aminomethyl)phenyl] hydrogen sulfate; methane

Systemtic Name: [2-(aminomethyl)phenyl] hydrogen sulfate; methane Openeye Name: [2-(aminomethyl)phenyl] hydrogen sulfate; methane CAS Name: methane; sulfuric acid [2-(aminomethyl)phenyl] ester IUPAC Name: [2-(aminomethyl)phenyl] hydrogen sulfate; methane Traditional Name: methane; sulfuric acid [2-(aminomethyl)phenyl] ester Formula: C8H13NO4S MolecularWeight: 219.25812

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Descriptors Computed from Structure

Canonical SMILES:

C.C1=CC=C(C(=C1)CN)OS(=O)(=O)O

Isomeric SMILES

C.C1=CC=C(C(=C1)CN)OS(=O)(=O)O

InChI

InChI=1S/C7H9NO4S.CH4/c8-5-6-3-1-2-4-7(6)12-13(9,10)11;/h1-4H,5,8H2,(H,9,10,11);1H4