1-(3-(2-(ALPHA-HYDROXYBENZYL)PHENOXY)PROPYL)-1-METHYLPIPERIDINIUM TOLUENESULFONATE

CAS No.
67360-98-9
CCD No.
CCD00242667
Formula
C22 H30 N O2 . C7 H7 O3 S
MolWeight
511.679

Basic Information

Product Name: 1-(3-(2-(ALPHA-HYDROXYBENZYL)PHENOXY)PROPYL)-1-METHYLPIPERIDINIUM TOLUENESULFONATE
CAS: 67360-98-9
English Synonyms: 1-(3-(2-(ALPHA-HYDROXYBENZYL)PHENOXY)PROPYL)-1-METHYLPIPERIDINIUM TOLUENESULFONATE
MDL Number.: MFCD01699753
H bond acceptor: 3
H bond donor: 1
Smile: Cc1ccc(cc1)S(=O)(=O)[O-].C[N+]1(CCCCC1)CCCOc2ccccc2C(c3ccccc3)O
InChi: InChI=1S/C22H30NO2.C7H8O3S/c1-23(15-8-3-9-16-23)17-10-18-25-21-14-7-6-13-20(21)22(24)19-11-4-2-5-12-19;1-6-2-4-7(5-3-6)11(8,9)10/h2,4-7,11-14,22,24H,3,8-10,15-18H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChiKey: InChIKey=XZBVCKQTNHKIDI-UHFFFAOYSA-M

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