5-(methylaminomethyl)naphthalene-1-sulfonic acid

Systemtic Name: 5-(methylaminomethyl)naphthalene-1-sulfonic acid Openeye Name: 5-(methylaminomethyl)naphthalene-1-sulfonic acid CAS Name: 5-(methylaminomethyl)-1-naphthalenesulfonic acid IUPAC Name: 5-(methylaminomethyl)naphthalene-1-sulfonic acid Traditional Name: 5-(methylaminomethyl)naphthalene-1-sulfonic acid Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC=CC2=C1C=CC=C2S(=O)(=O)O

Isomeric SMILES

CNCC1=CC=CC2=C1C=CC=C2S(=O)(=O)O

InChI

InChI=1S/C12H13NO3S/c1-13-8-9-4-2-6-11-10(9)5-3-7-12(11)17(14,15)16/h2-7,13H,8H2,1H3,(H,14,15,16)