4-oxidanylidene-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)butanoic acid

Systemtic Name: 4-oxidanylidene-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)butanoic acid Openeye Name: 4-oxo-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)butanoic acid CAS Name: 4-oxo-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)butanoic acid IUPAC Name: 4-oxo-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)butanoic acid Traditional Name: 4-keto-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)butyric acid Formula: C11H14N2O3S MolecularWeight: 254.30546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)CCC(=O)O

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)CCC(=O)O

InChI

InChI=1S/C11H14N2O3S/c14-9(5-6-10(15)16)13-11-12-7-3-1-2-4-8(7)17-11/h1-6H2,(H,15,16)(H,12,13,14)