Compound Name: | PINAVERIUM BROMIDE |
Compound CID: | 40703 |
Synonyms: | PINAVERIUM BROMIDE
53251-94-8
Pinaverium bromide INN
Dicetel
Pinaverium bromide (INN)
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Iupac Name: | 4-[(2-bromo-4,5-dimethoxyphenyl)methyl]-4-[2-[2-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)ethoxy]ethyl]morpholin-4-ium;bromide |
InChI: | InChI=1S/C26H41BrNO4.BrH/c1-26(2)21-6-5-19(22(26)16-21)7-11-31-12-8-28(9-13-32-14-10-28)18-20-15-24(29-3)25(30-4)17-23(20)27;/h15,17,19,21-22H,5-14,16,18H2,1-4H3;1H/q+1;/p-1 |
InChIKey: | IKGXLCMLVINENI-UHFFFAOYSA-M |
Canonical Smiles: | CC1(C2CCC(C1C2)CCOCC[N+]3(CCOCC3)CC4=CC(=C(C=C4Br)OC)OC)C.[Br-] |
Isomeric Smiles: | CC1(C2CCC(C1C2)CCOCC[N+]3(CCOCC3)CC4=CC(=C(C=C4Br)OC)OC)C.[Br-] |
Molecular Weight: | 591.4 |
Molecular Formula: | C26H41Br2NO4 |