(3-butylphenoxazin-10-yl) propane-1-sulfonate

Systemtic Name: (3-butylphenoxazin-10-yl) propane-1-sulfonate Openeye Name: (3-butylphenoxazin-10-yl) propane-1-sulfonate CAS Name: 1-propanesulfonic acid IUPAC Name: (3-butylphenoxazin-10-yl) propane-1-sulfonate Traditional Name: propane-1-sulfonic acid (3-butylphenoxazin-10-yl) ester Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N(C3=CC=CC=C3O2)OS(=O)(=O)CCC

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N(C3=CC=CC=C3O2)OS(=O)(=O)CCC

InChI

InChI=1S/C19H23NO4S/c1-3-5-8-15-11-12-17-19(14-15)23-18-10-7-6-9-16(18)20(17)24-25(21,22)13-4-2/h6-7,9-12,14H,3-5,8,13H2,1-2H3