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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1OC)N3CCC(CC3)C4=NOC5=C4C=CC(=C5)F)C(=O)NC2=O

Isomeric SMILES

CCC1=C2C(=CC(=C1OC)N3CCC(CC3)C4=NOC5=C4C=CC(=C5)F)C(=O)NC2=O

InChI

InChI=1S/C23H22FN3O4/c1-3-14-19-16(22(28)25-23(19)29)11-17(21(14)30-2)27-8-6-12(7-9-27)20-15-5-4-13(24)10-18(15)31-26-20/h4-5,10-12H,3,6-9H2,1-2H3,(H,25,28,29)