(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 3-(dimethylamino)benzoate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 3-(dimethylamino)benzoate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl 3-(dimethylamino)benzoate CAS Name: 3-(dimethylamino)benzoic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl 3-(dimethylamino)benzoate Traditional Name: 3-(dimethylamino)benzoic acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C19H16BrNO4 MolecularWeight: 402.23864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br

Isomeric SMILES

CN(C)C1=CC=CC(=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br

InChI

InChI=1S/C19H16BrNO4/c1-21(2)15-5-3-4-12(8-15)19(23)24-11-13-9-18(22)25-17-10-14(20)6-7-16(13)17/h3-10H,11H2,1-2H3