5-chloranyl-2-[4-methoxy-3-(2-piperidin-1-ylethoxy)phenyl]-3H-isoindol-1-one

Systemtic Name: 5-chloranyl-2-[4-methoxy-3-(2-piperidin-1-ylethoxy)phenyl]-3H-isoindol-1-one Openeye Name: 5-chloro-2-[4-methoxy-3-[2-(1-piperidyl)ethoxy]phenyl]isoindolin-1-one CAS Name: 5-chloro-2-[4-methoxy-3-[2-(1-piperidinyl)ethoxy]phenyl]-3H-isoindol-1-one IUPAC Name: 5-chloro-2-[4-methoxy-3-(2-piperidin-1-ylethoxy)phenyl]-3H-isoindol-1-one Traditional Name: 5-chloro-2-[4-methoxy-3-(2-piperidinoethoxy)phenyl]isoindolin-1-one Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2CC3=C(C2=O)C=CC(=C3)Cl)OCCN4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)N2CC3=C(C2=O)C=CC(=C3)Cl)OCCN4CCCCC4

InChI

InChI=1S/C22H25ClN2O3/c1-27-20-8-6-18(14-21(20)28-12-11-24-9-3-2-4-10-24)25-15-16-13-17(23)5-7-19(16)22(25)26/h5-8,13-14H,2-4,9-12,15H2,1H3