3-(ethylamino)-4-methyl-benzenesulfonic acid

Systemtic Name: 3-(ethylamino)-4-methyl-benzenesulfonic acid Openeye Name: 3-(ethylamino)-4-methyl-benzenesulfonic acid CAS Name: 3-(ethylamino)-4-methylbenzenesulfonic acid IUPAC Name: 3-(ethylamino)-4-methylbenzenesulfonic acid Traditional Name: 3-(ethylamino)-4-methyl-besylic acid Formula: C9H13NO3S MolecularWeight: 215.26942

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=CC(=C1)S(=O)(=O)O)C

Isomeric SMILES

CCNC1=C(C=CC(=C1)S(=O)(=O)O)C

InChI

InChI=1S/C9H13NO3S/c1-3-10-9-6-8(14(11,12)13)5-4-7(9)2/h4-6,10H,3H2,1-2H3,(H,11,12,13)