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2-cyclohexyl-5-(4-phenylpiperazin-1-yl)carbonyl-isoindole-1,3-dione

2-cyclohexyl-5-(4-phenylpiperazin-1-yl)carbonyl-isoindole-1,3-dione

Systemtic Name:2-cyclohexyl-5-(4-phenylpiperazin-1-yl)carbonyl-isoindole-1,3-dione
Openeye Name:2-cyclohexyl-5-(4-phenylpiperazine-1-carbonyl)isoindoline-1,3-dione
CAS Name:2-cyclohexyl-5-[oxo-(4-phenyl-1-piperazinyl)methyl]isoindole-1,3-dione
IUPAC Name:2-cyclohexyl-5-(4-phenylpiperazine-1-carbonyl)isoindole-1,3-dione
Traditional Name:2-cyclohexyl-5-(4-phenylpiperazine-1-carbonyl)isoindoline-1,3-quinone
Formula: C25H27N3O3
MolecularWeight: 417.50018
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5


Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5


InChI

InChI=1S/C25H27N3O3/c29-23(27-15-13-26(14-16-27)19-7-3-1-4-8-19)18-11-12-21-22(17-18)25(31)28(24(21)30)20-9-5-2-6-10-20/h1,3-4,7-8,11-12,17,20H,2,5-6,9-10,13-16H2


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