5-bromanyl-2-[4-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione

Systemtic Name: 5-bromanyl-2-[4-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione Openeye Name: 5-bromo-2-[4-[4-(m-tolylmethyl)piperazin-1-yl]-4-oxo-butyl]isoindoline-1,3-dione CAS Name: 5-bromo-2-[4-[4-[(3-methylphenyl)methyl]-1-piperazinyl]-4-oxobutyl]isoindole-1,3-dione IUPAC Name: 5-bromo-2-[4-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-4-oxobutyl]isoindole-1,3-dione Traditional Name: 5-bromo-2-[4-keto-4-[4-(3-methylbenzyl)piperazino]butyl]isoindoline-1,3-quinone Formula: C24H26BrN3O3 MolecularWeight: 484.38554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)CCCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)CCCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C24H26BrN3O3/c1-17-4-2-5-18(14-17)16-26-10-12-27(13-11-26)22(29)6-3-9-28-23(30)20-8-7-19(25)15-21(20)24(28)31/h2,4-5,7-8,14-15H,3,6,9-13,16H2,1H3