3-[(2-bromanyl-1-benzofuran-3-yl)methyl]-2-methyl-3-piperidin-4-yl-isoindol-1-one

Systemtic Name: 3-[(2-bromanyl-1-benzofuran-3-yl)methyl]-2-methyl-3-piperidin-4-yl-isoindol-1-one Openeye Name: 3-[(2-bromobenzofuran-3-yl)methyl]-2-methyl-3-(4-piperidyl)isoindolin-1-one CAS Name: 3-[(2-bromo-3-benzofuranyl)methyl]-2-methyl-3-(4-piperidinyl)-1-isoindolone IUPAC Name: 3-[(2-bromo-1-benzofuran-3-yl)methyl]-2-methyl-3-piperidin-4-ylisoindol-1-one Traditional Name: 3-[(2-bromobenzofuran-3-yl)methyl]-2-methyl-3-(4-piperidyl)isoindolin-1-one Formula: C23H23BrN2O2 MolecularWeight: 439.34492

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C1(CC3=C(OC4=CC=CC=C43)Br)C5CCNCC5

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C1(CC3=C(OC4=CC=CC=C43)Br)C5CCNCC5

InChI

InChI=1S/C23H23BrN2O2/c1-26-22(27)17-7-2-4-8-19(17)23(26,15-10-12-25-13-11-15)14-18-16-6-3-5-9-20(16)28-21(18)24/h2-9,15,25H,10-14H2,1H3