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Substance Name: Benzenesulfonic acid, 4-(4,5-dihydro-3-methyl-5-oxo-4-(3,5,5-trimethyl-2-cyclohexen-1-ylidene)-1H-pyrazol-1-yl)-, compd. with N,N-diethylethanamine (1:1)
RN: 62609-93-2
InChIKey: JFAHIWKRNXKGQD-SBBUSYCLSA-N

Molecular Formula

  • C19-H22-N2-O4-S.C6-H15-N

Molecular Weight

  • 475.65
 
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Names and Synonyms

  • Benzenesulfonic acid, 4-(4,5-dihydro-3-methyl-5-oxo-4-(3,5,5-trimethyl-2-cyclohexen-1-ylidene)-1H-pyrazol-1-yl)-, compd. with N,N-diethylethanamine (1:1)

Registry Numbers

CAS Registry Number

  • 62609-93-2

System Generated Number

  • 0062609932

Molecular Formulas

Molecular Formula

  • C19-H22-N2-O4-S.C6-H15-N

Molecular Formula Fragments

  • C19-H22-N2-O4-S
  • C6-H15-N
  • COMPONENT

Structure Descriptors

InChI

1S/C19H22N2O4S.C6H15N/c1-12-9-14(11-19(3,4)10-12)17-13(2)20-21(18(17)22)15-5-7-16(8-6-15)26(23,24)25;1-4-7(5-2)6-3/h5-9H,10-11H2,1-4H3,(H,23,24,25);4-6H2,1-3H3/b17-14-;

InChIKey

JFAHIWKRNXKGQD-SBBUSYCLSA-N

Smiles

O=C1N(N=C(C)\C1=C1/C=C(CC(C)(C)C1)C)c1ccc(cc1)S(=O)(=O)O.CCN(CC)CC