6-bromanyl-4-butylsulfinyl-3-propyl-chromen-2-one

Systemtic Name: 6-bromanyl-4-butylsulfinyl-3-propyl-chromen-2-one Openeye Name: 6-bromo-4-butylsulfinyl-3-propyl-chromen-2-one CAS Name: 6-bromo-4-butylsulfinyl-3-propyl-1-benzopyran-2-one IUPAC Name: 6-bromo-4-butylsulfinyl-3-propylchromen-2-one Traditional Name: 6-bromo-4-butylsulfinyl-3-propyl-coumarin Formula: C16H19BrO3S MolecularWeight: 371.28926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)C1=C(C(=O)OC2=C1C=C(C=C2)Br)CCC

Isomeric SMILES

CCCCS(=O)C1=C(C(=O)OC2=C1C=C(C=C2)Br)CCC

InChI

InChI=1S/C16H19BrO3S/c1-3-5-9-21(19)15-12(6-4-2)16(18)20-14-8-7-11(17)10-13(14)15/h7-8,10H,3-6,9H2,1-2H3