(4E)-2-chloranyl-4-(1-nitrosoethylidene)-1H-pyridine; 4-methylbenzenesulfonate

Systemtic Name: (4E)-2-chloranyl-4-(1-nitrosoethylidene)-1H-pyridine; 4-methylbenzenesulfonate Openeye Name: (4E)-2-chloro-4-(1-nitrosoethylidene)-1H-pyridine; 4-methylbenzenesulfonate CAS Name: (4E)-2-chloro-4-(1-nitrosoethylidene)-1H-pyridine; 4-methylbenzenesulfonate IUPAC Name: (4E)-2-chloro-4-(1-nitrosoethylidene)-1H-pyridine; 4-methylbenzenesulfonate Traditional Name: (4E)-2-chloro-4-(1-nitrosoethylidene)-1H-pyridine tosylate Formula: C14H14ClN2O4S- MolecularWeight: 341.78996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC(=C1C=CNC(=C1)Cl)N=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C/C(=C\1/C=CNC(=C1)Cl)/N=O

InChI

InChI=1S/C7H7ClN2O.C7H8O3S/c1-5(10-11)6-2-3-9-7(8)4-6;1-6-2-4-7(5-3-6)11(8,9)10/h2-4,9H,1H3;2-5H,1H3,(H,8,9,10)/p-1/b6-5+;