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(1,8-dimethylphenothiazin-10-yl) propane-1-sulfonate

(1,8-dimethylphenothiazin-10-yl) propane-1-sulfonate

Systemtic Name:(1,8-dimethylphenothiazin-10-yl) propane-1-sulfonate
Openeye Name:(1,8-dimethylphenothiazin-10-yl) propane-1-sulfonate
CAS Name:1-propanesulfonic acid
IUPAC Name:(1,8-dimethylphenothiazin-10-yl) propane-1-sulfonate
Traditional Name:propane-1-sulfonic acid (1,8-dimethylphenothiazin-10-yl) ester
Formula: C17H19NO3S2
MolecularWeight: 349.46766
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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)ON1C2=C(C=CC(=C2)C)SC3=CC=CC(=C31)C


Isomeric SMILES

CCCS(=O)(=O)ON1C2=C(C=CC(=C2)C)SC3=CC=CC(=C31)C


InChI

InChI=1S/C17H19NO3S2/c1-4-10-23(19,20)21-18-14-11-12(2)8-9-15(14)22-16-7-5-6-13(3)17(16)18/h5-9,11H,4,10H2,1-3H3


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