4-methylbenzenesulfonic acid; (2E)-2-(1-nitrosoethylidene)-1H-pyridine

Systemtic Name: 4-methylbenzenesulfonic acid; (2E)-2-(1-nitrosoethylidene)-1H-pyridine Openeye Name: 4-methylbenzenesulfonic acid; (2E)-2-(1-nitrosoethylidene)-1H-pyridine CAS Name: 4-methylbenzenesulfonic acid; (2E)-2-(1-nitrosoethylidene)-1H-pyridine IUPAC Name: 4-methylbenzenesulfonic acid; (2E)-2-(1-nitrosoethylidene)-1H-pyridine Traditional Name: (2E)-2-(1-nitrosoethylidene)-1H-pyridine; tosylic acid Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC(=C1C=CC=CN1)N=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C/C(=C\1/C=CC=CN1)/N=O

InChI

InChI=1S/C7H8N2O.C7H8O3S/c1-6(9-10)7-4-2-3-5-8-7;1-6-2-4-7(5-3-6)11(8,9)10/h2-5,8H,1H3;2-5H,1H3,(H,8,9,10)/b7-6+;