Nombre del analito

2-(2-(2-(4-(Dibenzo[b,f][1,4]thiazepin-11-yl)piperazin-1-yl)ethoxy)ethoxy)succinic Acid Sodium

Fórmula molecular

C25H27N3Na2O6S

Peso molecular

543.54

Masa exacta

543.1416

SMILES

O=C(O[Na])C(CC(O[Na])=O)OCCOCCN1CCN(C2=NC3=CC=CC=C3SC4=C2C=CC=C4)CC1

InChI

InChI=1S/C25H29N3O6S.2Na/c29-23(30)17-20(25(31)32)34-16-15-33-14-13-27-9-11-28(12-10-27)24-18-5-1-3-7-21(18)35-22-8-4-2-6-19(22)26-24;;/h1-8,20H,9-17H2,(H,29,30)(H,31,32);;/q;2*+1/p-2

IUPAC

sodium 2-(2-(2-(4-(dibenzo[b,f][1,4]thiazepin-11-yl)piperazin-1-yl)ethoxy)ethoxy)succinate

Alternar número CAS

Parent: 111974-69-7

País de origen

CANADA

Formato del producto

Neat