2-chloranyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline; 4-methylbenzenesulfonic acid

Systemtic Name: 2-chloranyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline; 4-methylbenzenesulfonic acid Openeye Name: 2-chloro-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline; 4-methylbenzenesulfonic acid CAS Name: 2-chloro-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline; 4-methylbenzenesulfonic acid IUPAC Name: 2-chloro-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline; 4-methylbenzenesulfonic acid Traditional Name: (2-chlorophenyl)-(2-imidazolin-2-ylmethyl)amine; tosylic acid Formula: C17H20ClN3O3S MolecularWeight: 381.877

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1CN=C(N1)CNC2=CC=CC=C2Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1CN=C(N1)CNC2=CC=CC=C2Cl

InChI

InChI=1S/C10H12ClN3.C7H8O3S/c11-8-3-1-2-4-9(8)14-7-10-12-5-6-13-10;1-6-2-4-7(5-3-6)11(8,9)10/h1-4,14H,5-7H2,(H,12,13);2-5H,1H3,(H,8,9,10)