Analyte Name

3-[N-(2-Carboxyethyl)methylamino]-7-[N-ethyl(3-sulfonatopropyl)amino]phenoxazin-5-ium

CAS Number

343257-52-3

Molecular Formula

C21H25N3O6S

Molecular Weight

447.5

Accurate Mass

447.15

SMILES

O=C(CCN(C)C1=CC=C2N=C3C=CC(N(CCCS(=O)(O)=O)CC)=CC3=[O+]C2=C1)[O-]

InChI

InChI=1S/C21H25N3O6S/c1-3-24(10-4-12-31(27,28)29)16-6-8-18-20(14-16)30-19-13-15(5-7-17(19)22-18)23(2)11-9-21(25)26/h5-8,13-14H,3-4,9-12H2,1-2H3,(H-,25,26,27,28,29)

IUPAC

3-((7-(ethyl(3-sulfopropyl)amino)phenoxazin-5-ium-3-yl)(methyl)amino)propanoate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat