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

Systemtic Name: 5-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]-4-propyl-isoindole-1,3-dione Openeye Name: 5-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidyl]-4-propyl-isoindoline-1,3-dione CAS Name: 5-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidinyl]-4-propylisoindole-1,3-dione IUPAC Name: 5-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]-4-propylisoindole-1,3-dione Traditional Name: 5-[4-(6-fluoroindoxazen-3-yl)piperidino]-4-propyl-isoindoline-1,3-quinone Formula: C23H22FN3O3 MolecularWeight: 407.437483

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1C(=O)NC2=O)N3CCC(CC3)C4=NOC5=C4C=CC(=C5)F

Isomeric SMILES

CCCC1=C(C=CC2=C1C(=O)NC2=O)N3CCC(CC3)C4=NOC5=C4C=CC(=C5)F

InChI

InChI=1S/C23H22FN3O3/c1-2-3-15-18(7-6-17-20(15)23(29)25-22(17)28)27-10-8-13(9-11-27)21-16-5-4-14(24)12-19(16)30-26-21/h4-7,12-13H,2-3,8-11H2,1H3,(H,25,28,29)