3-(4,7-diethoxy-1,3-benzothiazol-2-yl)propylazanium

Systemtic Name: 3-(4,7-diethoxy-1,3-benzothiazol-2-yl)propylazanium Openeye Name: 3-(4,7-diethoxy-1,3-benzothiazol-2-yl)propylammonium CAS Name: 3-(4,7-diethoxy-1,3-benzothiazol-2-yl)propylammonium IUPAC Name: 3-(4,7-diethoxy-1,3-benzothiazol-2-yl)propylazanium Traditional Name: 3-(4,7-diethoxy-1,3-benzothiazol-2-yl)propylammonium Formula: C14H21N2O2S+ MolecularWeight: 281.39374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=C(C=C1)OCC)SC(=N2)CCC[NH3+]

Isomeric SMILES

CCOC1=C2C(=C(C=C1)OCC)SC(=N2)CCC[NH3+]

InChI

InChI=1S/C14H20N2O2S/c1-3-17-10-7-8-11(18-4-2)14-13(10)16-12(19-14)6-5-9-15/h7-8H,3-6,9,15H2,1-2H3/p+1