6-(1,3-benzothiazol-2-ylamino)hexanoate

Systemtic Name: 6-(1,3-benzothiazol-2-ylamino)hexanoate Openeye Name: 6-(1,3-benzothiazol-2-ylamino)hexanoate CAS Name: 6-(1,3-benzothiazol-2-ylamino)hexanoate IUPAC Name: 6-(1,3-benzothiazol-2-ylamino)hexanoate Traditional Name: 6-(1,3-benzothiazol-2-ylamino)hexanoate Formula: C13H15N2O2S- MolecularWeight: 263.3354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NCCCCCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NCCCCCC(=O)[O-]

InChI

InChI=1S/C13H16N2O2S/c16-12(17)8-2-1-5-9-14-13-15-10-6-3-4-7-11(10)18-13/h3-4,6-7H,1-2,5,8-9H2,(H,14,15)(H,16,17)/p-1