5-(2-chloranylprop-2-enoxy)-4,7-dimethyl-3-(phenylmethyl)chromen-2-one

Systemtic Name: 5-(2-chloranylprop-2-enoxy)-4,7-dimethyl-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-5-(2-chloroallyloxy)-4,7-dimethyl-chromen-2-one CAS Name: 5-(2-chloroprop-2-enoxy)-4,7-dimethyl-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-5-(2-chloroprop-2-enoxy)-4,7-dimethylchromen-2-one Traditional Name: 3-benzyl-5-(2-chloroallyloxy)-4,7-dimethyl-coumarin Formula: C21H19ClO3 MolecularWeight: 354.82676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OCC(=C)Cl

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OCC(=C)Cl

InChI

InChI=1S/C21H19ClO3/c1-13-9-18(24-12-14(2)22)20-15(3)17(21(23)25-19(20)10-13)11-16-7-5-4-6-8-16/h4-10H,2,11-12H2,1,3H3