Benztropine mesylate[甲磺酸苯托品]

132-17-2

CAS Name

Benztropine mesylate

Molecular Formula

C₂₁H₂₅NO.CH₄O₃S

Compound Properties

• Melting Point (1)

  143 °C

Source(s)

• (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1/C21H25NO.CH4O3S/c1-22-18-12-13-19(22)15-20(14-18)23-21(16-8-4-2-5-9-16)17-10-6-3-7-11-17;1-5(2,3)4/h2-11,18-21H,12-15H2,1H3;1H3,(H,2,3,4)/t18-,19+,20+;

InChIKey

InChIKey=CPFJLLXFNPCTDW-BWSPSPBFNA-N

SMILES

C(O[C@H]1C[C@@]2(N(C)[C@](C1)(CC2)[H])[H])(C3=CC=CC=C3)C4=CC=CC=C4.S(C)(=O)(=O)O

Canonical SMILES

O=S(=O)(O)C.O(C(C=1C=CC=CC1)C=2C=CC=CC2)C3CC4N(C)C(CC4)C3

Other Names for this Substance