2-ethoxyethyl 3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoate

Systemtic Name: 2-ethoxyethyl 3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoate Openeye Name: 2-ethoxyethyl 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoate CAS Name: 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoate Traditional Name: 3-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]propionic acid 2-ethoxyethyl ester Formula: C14H18N2O5S MolecularWeight: 326.36812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)CCNC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

CCOCCOC(=O)CCNC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C14H18N2O5S/c1-2-20-9-10-21-13(17)7-8-15-14-11-5-3-4-6-12(11)22(18,19)16-14/h3-6H,2,7-10H2,1H3,(H,15,16)