5-[3-(1,3-benzoxazol-2-ylmethyl)cyclohexyl]-9-chloranyl-3-methyl-[1,2]oxazolo[4,3-c]quinolin-4-one

Systemtic Name: 5-[3-(1,3-benzoxazol-2-ylmethyl)cyclohexyl]-9-chloranyl-3-methyl-[1,2]oxazolo[4,3-c]quinolin-4-one Openeye Name: 5-[3-(1,3-benzoxazol-2-ylmethyl)cyclohexyl]-9-chloro-3-methyl-isoxazolo[4,3-c]quinolin-4-one CAS Name: 5-[3-(1,3-benzoxazol-2-ylmethyl)cyclohexyl]-9-chloro-3-methyl-4-isoxazolo[4,3-c]quinolinone IUPAC Name: 5-[3-(1,3-benzoxazol-2-ylmethyl)cyclohexyl]-9-chloro-3-methyl-[1,2]oxazolo[4,3-c]quinolin-4-one Traditional Name: 5-[3-(1,3-benzoxazol-2-ylmethyl)cyclohexyl]-9-chloro-3-methyl-isoxazolo[4,3-c]quinolin-4-one Formula: C25H22ClN3O3 MolecularWeight: 447.91348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NO1)C3=C(C=CC=C3Cl)N(C2=O)C4CCCC(C4)CC5=NC6=CC=CC=C6O5

Isomeric SMILES

CC1=C2C(=NO1)C3=C(C=CC=C3Cl)N(C2=O)C4CCCC(C4)CC5=NC6=CC=CC=C6O5

InChI

InChI=1S/C25H22ClN3O3/c1-14-22-24(28-32-14)23-17(26)8-5-10-19(23)29(25(22)30)16-7-4-6-15(12-16)13-21-27-18-9-2-3-11-20(18)31-21/h2-3,5,8-11,15-16H,4,6-7,12-13H2,1H3