diethyl-[2-oxidanylidene-3-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]chromen-7-yl]azanium bromide

Systemtic Name: diethyl-[2-oxidanylidene-3-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]chromen-7-yl]azanium bromide Openeye Name: diethyl-[2-oxo-3-[4-(2-oxochromen-3-yl)thiazol-2-yl]chromen-7-yl]ammonium bromide CAS Name: diethyl-[2-oxo-3-[4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-1-benzopyran-7-yl]ammonium bromide IUPAC Name: diethyl-[2-oxo-3-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]chromen-7-yl]azanium bromide Traditional Name: diethyl-[2-keto-3-[4-(2-ketochromen-3-yl)thiazol-2-yl]chromen-7-yl]ammonium bromide Formula: C25H21BrN2O4S MolecularWeight: 525.41424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC(=CS3)C4=CC5=CC=CC=C5OC4=O.[Br-]

Isomeric SMILES

CC[NH+](CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC(=CS3)C4=CC5=CC=CC=C5OC4=O.[Br-]

InChI

InChI=1S/C25H20N2O4S.BrH/c1-3-27(4-2)17-10-9-16-12-19(25(29)31-22(16)13-17)23-26-20(14-32-23)18-11-15-7-5-6-8-21(15)30-24(18)28;/h5-14H,3-4H2,1-2H3;1H