(4-propylphenoxazin-10-yl) propane-1-sulfonate

Systemtic Name: (4-propylphenoxazin-10-yl) propane-1-sulfonate Openeye Name: (4-propylphenoxazin-10-yl) propane-1-sulfonate CAS Name: 1-propanesulfonic acid IUPAC Name: (4-propylphenoxazin-10-yl) propane-1-sulfonate Traditional Name: propane-1-sulfonic acid (4-propylphenoxazin-10-yl) ester Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC=C1)N(C3=CC=CC=C3O2)OS(=O)(=O)CCC

Isomeric SMILES

CCCC1=C2C(=CC=C1)N(C3=CC=CC=C3O2)OS(=O)(=O)CCC

InChI

InChI=1S/C18H21NO4S/c1-3-8-14-9-7-11-16-18(14)22-17-12-6-5-10-15(17)19(16)23-24(20,21)13-4-2/h5-7,9-12H,3-4,8,13H2,1-2H3