2-[4-(4-bromophenyl)-2-(8-methoxy-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[4-(4-bromophenyl)-2-(8-methoxy-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[4-(4-bromophenyl)-2-(8-methoxy-2-oxo-chromen-3-yl)thiazol-5-yl]acetic acid CAS Name: 2-[4-(4-bromophenyl)-2-(8-methoxy-2-oxo-1-benzopyran-3-yl)-5-thiazolyl]acetic acid IUPAC Name: 2-[4-(4-bromophenyl)-2-(8-methoxy-2-oxochromen-3-yl)-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[4-(4-bromophenyl)-2-(2-keto-8-methoxy-chromen-3-yl)thiazol-5-yl]acetic acid Formula: C21H14BrNO5S MolecularWeight: 472.30856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=O)C(=C2)C3=NC(=C(S3)CC(=O)O)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=CC2=C1OC(=O)C(=C2)C3=NC(=C(S3)CC(=O)O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H14BrNO5S/c1-27-15-4-2-3-12-9-14(21(26)28-19(12)15)20-23-18(16(29-20)10-17(24)25)11-5-7-13(22)8-6-11/h2-9H,10H2,1H3,(H,24,25)