[3-(1,3-benzothiazol-2-yl)-4-oxidanylidene-chromen-7-yl] 2-bromanylbenzoate

Systemtic Name: [3-(1,3-benzothiazol-2-yl)-4-oxidanylidene-chromen-7-yl] 2-bromanylbenzoate Openeye Name: [3-(1,3-benzothiazol-2-yl)-4-oxo-chromen-7-yl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [3-(1,3-benzothiazol-2-yl)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(1,3-benzothiazol-2-yl)-4-oxochromen-7-yl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [3-(1,3-benzothiazol-2-yl)-4-keto-chromen-7-yl] ester Formula: C23H12BrNO4S MolecularWeight: 478.31468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=NC5=CC=CC=C5S4)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=NC5=CC=CC=C5S4)Br

InChI

InChI=1S/C23H12BrNO4S/c24-17-6-2-1-5-14(17)23(27)29-13-9-10-15-19(11-13)28-12-16(21(15)26)22-25-18-7-3-4-8-20(18)30-22/h1-12H