5-phenyl-2-[[2-[4-(phenylcarbonyl)piperazin-1-yl]ethylamino]methylidene]cyclohexane-1,3-dione

Systemtic Name: 5-phenyl-2-[[2-[4-(phenylcarbonyl)piperazin-1-yl]ethylamino]methylidene]cyclohexane-1,3-dione Openeye Name: 2-[[2-(4-benzoylpiperazin-1-yl)ethylamino]methylene]-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-[[2-(4-benzoyl-1-piperazinyl)ethylamino]methylidene]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[[2-(4-benzoylpiperazin-1-yl)ethylamino]methylidene]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[[2-(4-benzoylpiperazino)ethylamino]methylene]-5-phenyl-cyclohexane-1,3-quinone Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC=C2C(=O)CC(CC2=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCNC=C2C(=O)CC(CC2=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3/c30-24-17-22(20-7-3-1-4-8-20)18-25(31)23(24)19-27-11-12-28-13-15-29(16-14-28)26(32)21-9-5-2-6-10-21/h1-10,19,22,27H,11-18H2