5-bromanyl-2-[4-oxidanylidene-4-[4-[oxidanyl(phenyl)methyl]piperidin-1-yl]butyl]isoindole-1,3-dione

Systemtic Name: 5-bromanyl-2-[4-oxidanylidene-4-[4-[oxidanyl(phenyl)methyl]piperidin-1-yl]butyl]isoindole-1,3-dione Openeye Name: 5-bromo-2-[4-[4-[hydroxy(phenyl)methyl]-1-piperidyl]-4-oxo-butyl]isoindoline-1,3-dione CAS Name: 5-bromo-2-[4-[4-[hydroxy(phenyl)methyl]-1-piperidinyl]-4-oxobutyl]isoindole-1,3-dione IUPAC Name: 5-bromo-2-[4-[4-[hydroxy(phenyl)methyl]piperidin-1-yl]-4-oxobutyl]isoindole-1,3-dione Traditional Name: 5-bromo-2-[4-[4-[hydroxy(phenyl)methyl]piperidino]-4-keto-butyl]isoindoline-1,3-quinone Formula: C24H25BrN2O4 MolecularWeight: 485.3703

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(C2=CC=CC=C2)O)C(=O)CCCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1CN(CCC1C(C2=CC=CC=C2)O)C(=O)CCCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C24H25BrN2O4/c25-18-8-9-19-20(15-18)24(31)27(23(19)30)12-4-7-21(28)26-13-10-17(11-14-26)22(29)16-5-2-1-3-6-16/h1-3,5-6,8-9,15,17,22,29H,4,7,10-14H2