6-azanyl-2,4-bis(chloranyl)-3-ethyl-phenol; 4-methylbenzenesulfonic acid

Systemtic Name: 6-azanyl-2,4-bis(chloranyl)-3-ethyl-phenol; 4-methylbenzenesulfonic acid Openeye Name: 6-amino-2,4-dichloro-3-ethyl-phenol; 4-methylbenzenesulfonic acid CAS Name: 6-amino-2,4-dichloro-3-ethylphenol; 4-methylbenzenesulfonic acid IUPAC Name: 6-amino-2,4-dichloro-3-ethylphenol; 4-methylbenzenesulfonic acid Traditional Name: 6-amino-2,4-dichloro-3-ethyl-phenol; tosylic acid Formula: C15H17Cl2NO4S MolecularWeight: 378.27078

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1Cl)O)N)Cl.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCC1=C(C=C(C(=C1Cl)O)N)Cl.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C8H9Cl2NO.C7H8O3S/c1-2-4-5(9)3-6(11)8(12)7(4)10;1-6-2-4-7(5-3-6)11(8,9)10/h3,12H,2,11H2,1H3;2-5H,1H3,(H,8,9,10)