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(1,3,6-trimethylphenoxazin-10-yl) propane-1-sulfonate

(1,3,6-trimethylphenoxazin-10-yl) propane-1-sulfonate

Systemtic Name:(1,3,6-trimethylphenoxazin-10-yl) propane-1-sulfonate
Openeye Name:(1,3,6-trimethylphenoxazin-10-yl) propane-1-sulfonate
CAS Name:1-propanesulfonic acid
IUPAC Name:(1,3,6-trimethylphenoxazin-10-yl) propane-1-sulfonate
Traditional Name:propane-1-sulfonic acid (1,3,6-trimethylphenoxazin-10-yl) ester
Formula: C18H21NO4S
MolecularWeight: 347.42864
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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)ON1C2=CC=CC(=C2OC3=CC(=CC(=C31)C)C)C


Isomeric SMILES

CCCS(=O)(=O)ON1C2=CC=CC(=C2OC3=CC(=CC(=C31)C)C)C


InChI

InChI=1S/C18H21NO4S/c1-5-9-24(20,21)23-19-15-8-6-7-13(3)18(15)22-16-11-12(2)10-14(4)17(16)19/h6-8,10-11H,5,9H2,1-4H3


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