methyl (6E)-6-(3-methyl-1,3-benzothiazol-2-ylidene)-5-oxidanylidene-hexanoate

Systemtic Name: methyl (6E)-6-(3-methyl-1,3-benzothiazol-2-ylidene)-5-oxidanylidene-hexanoate Openeye Name: methyl (6E)-6-(3-methyl-1,3-benzothiazol-2-ylidene)-5-oxo-hexanoate CAS Name: (6E)-6-(3-methyl-1,3-benzothiazol-2-ylidene)-5-oxohexanoic acid methyl ester IUPAC Name: methyl (6E)-6-(3-methyl-1,3-benzothiazol-2-ylidene)-5-oxohexanoate Traditional Name: (6E)-5-keto-6-(3-methyl-1,3-benzothiazol-2-ylidene)hexanoic acid methyl ester Formula: C15H17NO3S MolecularWeight: 291.36538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC1=CC(=O)CCCC(=O)OC

Isomeric SMILES

CN\1C2=CC=CC=C2S/C1=C/C(=O)CCCC(=O)OC

InChI

InChI=1S/C15H17NO3S/c1-16-12-7-3-4-8-13(12)20-14(16)10-11(17)6-5-9-15(18)19-2/h3-4,7-8,10H,5-6,9H2,1-2H3/b14-10+