2-azanyl-5-(diethylamino)-3-methyl-benzenesulfonic acid

Systemtic Name: 2-azanyl-5-(diethylamino)-3-methyl-benzenesulfonic acid Openeye Name: 2-amino-5-(diethylamino)-3-methyl-benzenesulfonic acid CAS Name: 2-amino-5-(diethylamino)-3-methylbenzenesulfonic acid IUPAC Name: 2-amino-5-(diethylamino)-3-methylbenzenesulfonic acid Traditional Name: 2-amino-5-(diethylamino)-3-methyl-besylic acid Formula: C11H18N2O3S MolecularWeight: 258.33722

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C(=C1)C)N)S(=O)(=O)O

Isomeric SMILES

CCN(CC)C1=CC(=C(C(=C1)C)N)S(=O)(=O)O

InChI

InChI=1S/C11H18N2O3S/c1-4-13(5-2)9-6-8(3)11(12)10(7-9)17(14,15)16/h6-7H,4-5,12H2,1-3H3,(H,14,15,16)