2-methyl-3-phenylazanyl-propane-1-sulfonic acid

Systemtic Name: 2-methyl-3-phenylazanyl-propane-1-sulfonic acid Openeye Name: 3-anilino-2-methyl-propane-1-sulfonic acid CAS Name: 3-anilino-2-methyl-1-propanesulfonic acid IUPAC Name: 3-anilino-2-methylpropane-1-sulfonic acid Traditional Name: 3-anilino-2-methyl-propane-1-sulfonic acid Formula: C10H15NO3S MolecularWeight: 229.296

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=CC=CC=C1)CS(=O)(=O)O

Isomeric SMILES

CC(CNC1=CC=CC=C1)CS(=O)(=O)O

InChI

InChI=1S/C10H15NO3S/c1-9(8-15(12,13)14)7-11-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H,12,13,14)