5-(3H-1,3-benzothiazol-2-ylidene)-6-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)hexanoate

Systemtic Name: 5-(3H-1,3-benzothiazol-2-ylidene)-6-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)hexanoate Openeye Name: 5-(3H-1,3-benzothiazol-2-ylidene)-6-(4-oxocyclohexa-2,5-dien-1-ylidene)hexanoate CAS Name: 5-(3H-1,3-benzothiazol-2-ylidene)-6-(4-oxo-1-cyclohexa-2,5-dienylidene)hexanoate IUPAC Name: 5-(3H-1,3-benzothiazol-2-ylidene)-6-(4-oxocyclohexa-2,5-dien-1-ylidene)hexanoate Traditional Name: 5-(3H-1,3-benzothiazol-2-ylidene)-6-(4-ketocyclohexa-2,5-dien-1-ylidene)hexanoate Formula: C19H16NO3S- MolecularWeight: 338.40024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(CCCC(=O)[O-])C=C3C=CC(=O)C=C3)S2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C(CCCC(=O)[O-])C=C3C=CC(=O)C=C3)S2

InChI

InChI=1S/C19H17NO3S/c21-15-10-8-13(9-11-15)12-14(4-3-7-18(22)23)19-20-16-5-1-2-6-17(16)24-19/h1-2,5-6,8-12,20H,3-4,7H2,(H,22,23)/p-1