6-bromanyl-3-(3,4-diethoxyphenyl)chromen-2-one

Systemtic Name: 6-bromanyl-3-(3,4-diethoxyphenyl)chromen-2-one Openeye Name: 6-bromo-3-(3,4-diethoxyphenyl)chromen-2-one CAS Name: 6-bromo-3-(3,4-diethoxyphenyl)-1-benzopyran-2-one IUPAC Name: 6-bromo-3-(3,4-diethoxyphenyl)chromen-2-one Traditional Name: 6-bromo-3-(3,4-diethoxyphenyl)coumarin Formula: C19H17BrO4 MolecularWeight: 389.23988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=CC3=C(C=CC(=C3)Br)OC2=O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=CC3=C(C=CC(=C3)Br)OC2=O)OCC

InChI

InChI=1S/C19H17BrO4/c1-3-22-17-7-5-12(11-18(17)23-4-2)15-10-13-9-14(20)6-8-16(13)24-19(15)21/h5-11H,3-4H2,1-2H3