2-[2-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5-methoxy-isoindole-1,3-dione

Systemtic Name: 2-[2-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5-methoxy-isoindole-1,3-dione Openeye Name: 2-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidyl]ethyl]-5-methoxy-isoindoline-1,3-dione CAS Name: 2-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidinyl]ethyl]-5-methoxyisoindole-1,3-dione IUPAC Name: 2-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5-methoxyisoindole-1,3-dione Traditional Name: 2-[2-[4-(6-fluoroindoxazen-3-yl)piperidino]ethyl]-5-methoxy-isoindoline-1,3-quinone Formula: C23H22FN3O4 MolecularWeight: 423.436883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)N(C2=O)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)N(C2=O)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F

InChI

InChI=1S/C23H22FN3O4/c1-30-16-3-5-17-19(13-16)23(29)27(22(17)28)11-10-26-8-6-14(7-9-26)21-18-4-2-15(24)12-20(18)31-25-21/h2-5,12-14H,6-11H2,1H3