[6-[2,3-bis(bromanyl)propyl]-3-cyano-4,8-dimethyl-2-oxidanylidene-chromen-7-yl] ethanoate

Systemtic Name: [6-[2,3-bis(bromanyl)propyl]-3-cyano-4,8-dimethyl-2-oxidanylidene-chromen-7-yl] ethanoate Openeye Name: [3-cyano-6-(2,3-dibromopropyl)-4,8-dimethyl-2-oxo-chromen-7-yl] acetate CAS Name: acetic acid [3-cyano-6-(2,3-dibromopropyl)-4,8-dimethyl-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-cyano-6-(2,3-dibromopropyl)-4,8-dimethyl-2-oxochromen-7-yl] acetate Traditional Name: acetic acid [3-cyano-6-(2,3-dibromopropyl)-2-keto-4,8-dimethyl-chromen-7-yl] ester Formula: C17H15Br2NO4 MolecularWeight: 457.1133

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C(C(=C(C=C12)CC(CBr)Br)OC(=O)C)C)C#N

Isomeric SMILES

CC1=C(C(=O)OC2=C(C(=C(C=C12)CC(CBr)Br)OC(=O)C)C)C#N

InChI

InChI=1S/C17H15Br2NO4/c1-8-13-5-11(4-12(19)6-18)15(23-10(3)21)9(2)16(13)24-17(22)14(8)7-20/h5,12H,4,6H2,1-3H3