8-iodanyl-6-methyl-3,3-bis(pyrrolidin-1-ylmethyl)-2H-chromen-4-one

Systemtic Name: 8-iodanyl-6-methyl-3,3-bis(pyrrolidin-1-ylmethyl)-2H-chromen-4-one Openeye Name: 8-iodo-6-methyl-3,3-bis(pyrrolidin-1-ylmethyl)chroman-4-one CAS Name: 8-iodo-6-methyl-3,3-bis(1-pyrrolidinylmethyl)-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 8-iodo-6-methyl-3,3-bis(pyrrolidin-1-ylmethyl)-2H-chromen-4-one Traditional Name: 8-iodo-6-methyl-3,3-bis(pyrrolidinomethyl)chroman-4-one Formula: C20H27IN2O2 MolecularWeight: 454.34505

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C(CO2)(CN3CCCC3)CN4CCCC4)I

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C(CO2)(CN3CCCC3)CN4CCCC4)I

InChI

InChI=1S/C20H27IN2O2/c1-15-10-16-18(17(21)11-15)25-14-20(19(16)24,12-22-6-2-3-7-22)13-23-8-4-5-9-23/h10-11H,2-9,12-14H2,1H3