5-iodanyl-7-methyl-3,3-bis(piperidin-1-ylmethyl)-2H-chromen-4-one

Systemtic Name: 5-iodanyl-7-methyl-3,3-bis(piperidin-1-ylmethyl)-2H-chromen-4-one Openeye Name: 5-iodo-7-methyl-3,3-bis(1-piperidylmethyl)chroman-4-one CAS Name: 5-iodo-7-methyl-3,3-bis(1-piperidinylmethyl)-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 5-iodo-7-methyl-3,3-bis(piperidin-1-ylmethyl)-2H-chromen-4-one Traditional Name: 5-iodo-7-methyl-3,3-bis(piperidinomethyl)chroman-4-one Formula: C22H31IN2O2 MolecularWeight: 482.39821

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1)I)C(=O)C(CO2)(CN3CCCCC3)CN4CCCCC4

Isomeric SMILES

CC1=CC2=C(C(=C1)I)C(=O)C(CO2)(CN3CCCCC3)CN4CCCCC4

InChI

InChI=1S/C22H31IN2O2/c1-17-12-18(23)20-19(13-17)27-16-22(21(20)26,14-24-8-4-2-5-9-24)15-25-10-6-3-7-11-25/h12-13H,2-11,14-16H2,1H3