6-chloranyl-7-methyl-2-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]carbonyl-chromen-4-one

Systemtic Name: 6-chloranyl-7-methyl-2-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]carbonyl-chromen-4-one Openeye Name: 6-chloro-7-methyl-2-[4-[2-(4-pyridyl)ethyl]piperazine-1-carbonyl]chromen-4-one CAS Name: 6-chloro-7-methyl-2-[oxo-[4-(2-pyridin-4-ylethyl)-1-piperazinyl]methyl]-1-benzopyran-4-one IUPAC Name: 6-chloro-7-methyl-2-[4-(2-pyridin-4-ylethyl)piperazine-1-carbonyl]chromen-4-one Traditional Name: 6-chloro-7-methyl-2-[4-[2-(4-pyridyl)ethyl]piperazine-1-carbonyl]chromone Formula: C22H22ClN3O3 MolecularWeight: 411.88138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=CC2=O)C(=O)N3CCN(CC3)CCC4=CC=NC=C4)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=CC2=O)C(=O)N3CCN(CC3)CCC4=CC=NC=C4)Cl

InChI

InChI=1S/C22H22ClN3O3/c1-15-12-20-17(13-18(15)23)19(27)14-21(29-20)22(28)26-10-8-25(9-11-26)7-4-16-2-5-24-6-3-16/h2-3,5-6,12-14H,4,7-11H2,1H3