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

Systemtic Name: [3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxidanylidene-chromen-7-yl] 2-bromanylbenzoate Openeye Name: [3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-chromen-7-yl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxochromen-7-yl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [3-(1,3-benzothiazol-2-yl)-4-keto-2-methyl-chromen-7-yl] ester Formula: C24H14BrNO4S MolecularWeight: 492.34126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC=CC=C3Br)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC=CC=C3Br)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H14BrNO4S/c1-13-21(23-26-18-8-4-5-9-20(18)31-23)22(27)16-11-10-14(12-19(16)29-13)30-24(28)15-6-2-3-7-17(15)25/h2-12H,1H3