[(3E)-3-(3H-1,3-benzothiazol-2-ylidene)-3-cyano-2-oxidanylidene-propyl] 9,10-bis(oxidanylidene)anthracene-1-carboxylate

Systemtic Name: [(3E)-3-(3H-1,3-benzothiazol-2-ylidene)-3-cyano-2-oxidanylidene-propyl] 9,10-bis(oxidanylidene)anthracene-1-carboxylate Openeye Name: [(3E)-3-(3H-1,3-benzothiazol-2-ylidene)-3-cyano-2-oxo-propyl] 9,10-dioxoanthracene-1-carboxylate CAS Name: 9,10-dioxo-1-anthracenecarboxylic acid [(3E)-3-(3H-1,3-benzothiazol-2-ylidene)-3-cyano-2-oxopropyl] ester IUPAC Name: [(3E)-3-(3H-1,3-benzothiazol-2-ylidene)-3-cyano-2-oxopropyl] 9,10-dioxoanthracene-1-carboxylate Traditional Name: 9,10-diketoanthracene-1-carboxylic acid [(3E)-3-(3H-1,3-benzothiazol-2-ylidene)-3-cyano-2-keto-propyl] ester Formula: C26H14N2O5S MolecularWeight: 466.46476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)C(=O)OCC(=O)C(=C4NC5=CC=CC=C5S4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)C(=O)OCC(=O)/C(=C/4\NC5=CC=CC=C5S4)/C#N

InChI

InChI=1S/C26H14N2O5S/c27-12-18(25-28-19-10-3-4-11-21(19)34-25)20(29)13-33-26(32)17-9-5-8-16-22(17)24(31)15-7-2-1-6-14(15)23(16)30/h1-11,28H,13H2/b25-18+