5-bromanyl-7-methyl-2-[(4-phenoxyphenyl)methyl]-3H-isoindol-1-one

Systemtic Name: 5-bromanyl-7-methyl-2-[(4-phenoxyphenyl)methyl]-3H-isoindol-1-one Openeye Name: 5-bromo-7-methyl-2-[(4-phenoxyphenyl)methyl]isoindolin-1-one CAS Name: 5-bromo-7-methyl-2-[(4-phenoxyphenyl)methyl]-3H-isoindol-1-one IUPAC Name: 5-bromo-7-methyl-2-[(4-phenoxyphenyl)methyl]-3H-isoindol-1-one Traditional Name: 5-bromo-7-methyl-2-(4-phenoxybenzyl)isoindolin-1-one Formula: C22H18BrNO2 MolecularWeight: 408.28782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)Br)CN(C2=O)CC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC(=C1)Br)CN(C2=O)CC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C22H18BrNO2/c1-15-11-18(23)12-17-14-24(22(25)21(15)17)13-16-7-9-20(10-8-16)26-19-5-3-2-4-6-19/h2-12H,13-14H2,1H3