2-[[4-[(6-chloranylpyridin-2-yl)methoxy]phenyl]-cyclohexyl-methoxy]isoindole-1,3-dione

Systemtic Name: 2-[[4-[(6-chloranylpyridin-2-yl)methoxy]phenyl]-cyclohexyl-methoxy]isoindole-1,3-dione Openeye Name: 2-[[4-[(6-chloro-2-pyridyl)methoxy]phenyl]-cyclohexyl-methoxy]isoindoline-1,3-dione CAS Name: 2-[[4-[(6-chloro-2-pyridinyl)methoxy]phenyl]-cyclohexylmethoxy]isoindole-1,3-dione IUPAC Name: 2-[[4-[(6-chloropyridin-2-yl)methoxy]phenyl]-cyclohexylmethoxy]isoindole-1,3-dione Traditional Name: 2-[[4-[(6-chloro-2-pyridyl)methoxy]phenyl]-cyclohexyl-methoxy]isoindoline-1,3-quinone Formula: C27H25ClN2O4 MolecularWeight: 476.9514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2=CC=C(C=C2)OCC3=NC(=CC=C3)Cl)ON4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CCC(CC1)C(C2=CC=C(C=C2)OCC3=NC(=CC=C3)Cl)ON4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H25ClN2O4/c28-24-12-6-9-20(29-24)17-33-21-15-13-19(14-16-21)25(18-7-2-1-3-8-18)34-30-26(31)22-10-4-5-11-23(22)27(30)32/h4-6,9-16,18,25H,1-3,7-8,17H2