Physostigmine salicylate,CAS#57-64-7

CAS # 57-64-7, Physostigmine Salicylate
Name
Physostigmine Salicylate
Synonyms
N-Methylcarbamic Acid [(3Ar,8Bs)-3,4,8B-Trimethyl-2,3A-Dihydro-1H-Pyrrolo[2,3-B]Indole-3,4-Diium-7-Yl] Ester; 2-Oxidobenzoate; Physostigmine Monosalicylate; Physostigmine Salicylate [Usan:Jan]
Molecular Formula
C22H27N3O5
Molecular Weight 413.47
CAS Registry Number
57-64-7
EINECS 200-343-8
SMILES
[C@@H]12[NH+](C3=C([C@@]1(CC[NH+]2C)C)C=C(OC(=O)NC)C=C3)C.C4=C(C(=CC=C4)[O-])C([O-])=O
InChI
1S/C15H21N3O2.C7H6O3/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2;8-6-4-2-1-3-5(6)7(9)10/h5-6,9,13H,7-8H2,1-4H3,(H,16,19);1-4,8H,(H,9,10)/t13-,15+;/m1./s1
InChIKey HZOTZTANVBDFOF-PBCQUBLHSA-N

Leave a Reply