2-[2-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-4H-isoquinoline-1,3-dione

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NOC3=C2C=CC(=C3)F)CCN4C(=O)CC5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCC1C2=NOC3=C2C=CC(=C3)F)CCN4C(=O)CC5=CC=CC=C5C4=O

InChI

InChI=1S/C23H22FN3O3/c24-17-5-6-19-20(14-17)30-25-22(19)15-7-9-26(10-8-15)11-12-27-21(28)13-16-3-1-2-4-18(16)23(27)29/h1-6,14-15H,7-13H2