4-butyl-6-chloranyl-7-(2-chloranylprop-2-enoxy)chromen-2-one

Systemtic Name: 4-butyl-6-chloranyl-7-(2-chloranylprop-2-enoxy)chromen-2-one Openeye Name: 4-butyl-6-chloro-7-(2-chloroallyloxy)chromen-2-one CAS Name: 4-butyl-6-chloro-7-(2-chloroprop-2-enoxy)-1-benzopyran-2-one IUPAC Name: 4-butyl-6-chloro-7-(2-chloroprop-2-enoxy)chromen-2-one Traditional Name: 4-butyl-6-chloro-7-(2-chloroallyloxy)coumarin Formula: C16H16Cl2O3 MolecularWeight: 327.20244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=C)Cl

Isomeric SMILES

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=C)Cl

InChI

InChI=1S/C16H16Cl2O3/c1-3-4-5-11-6-16(19)21-14-8-15(20-9-10(2)17)13(18)7-12(11)14/h6-8H,2-5,9H2,1H3