4-methylbenzenesulfonic acid; (NE)-N-[(2S,6S)-6-methyl-2-phenyl-piperidin-3-ylidene]hydroxylamine

Systemtic Name: 4-methylbenzenesulfonic acid; (NE)-N-[(2S,6S)-6-methyl-2-phenyl-piperidin-3-ylidene]hydroxylamine Openeye Name: 4-methylbenzenesulfonic acid; (2S,6S)-6-methyl-2-phenyl-piperidin-3-one oxime CAS Name: 4-methylbenzenesulfonic acid; (2S,6S)-6-methyl-2-phenyl-3-piperidinone oxime IUPAC Name: 4-methylbenzenesulfonic acid; (NE)-N-[(2S,6S)-6-methyl-2-phenylpiperidin-3-ylidene]hydroxylamine Traditional Name: (2S,6S)-6-methyl-2-phenyl-piperidin-3-one oxime; tosylic acid Formula: C19H24N2O4S MolecularWeight: 376.46986

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=NO)C(N1)C2=CC=CC=C2.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

C[C@H]1CC/C(=N\O)/[C@@H](N1)C2=CC=CC=C2.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C12H16N2O.C7H8O3S/c1-9-7-8-11(14-15)12(13-9)10-5-3-2-4-6-10;1-6-2-4-7(5-3-6)11(8,9)10/h2-6,9,12-13,15H,7-8H2,1H3;2-5H,1H3,(H,8,9,10)/b14-11+;/t9-,12-;/m0./s1