9-[4-(2-cyclohexyl-3-oxidanylidene-1-piperazin-1-yl-isoindol-1-yl)butyl]-N-(phenylmethyl)fluorene-9-carboxamide

Systemtic Name: 9-[4-(2-cyclohexyl-3-oxidanylidene-1-piperazin-1-yl-isoindol-1-yl)butyl]-N-(phenylmethyl)fluorene-9-carboxamide Openeye Name: N-benzyl-9-[4-(2-cyclohexyl-3-oxo-1-piperazin-1-yl-isoindolin-1-yl)butyl]fluorene-9-carboxamide CAS Name: 9-[4-[2-cyclohexyl-3-oxo-1-(1-piperazinyl)-1-isoindolyl]butyl]-N-(phenylmethyl)-9-fluorenecarboxamide IUPAC Name: N-benzyl-9-[4-(2-cyclohexyl-3-oxo-1-piperazin-1-ylisoindol-1-yl)butyl]fluorene-9-carboxamide Traditional Name: N-benzyl-9-[4-(2-cyclohexyl-3-keto-1-piperazino-isoindolin-1-yl)butyl]fluorene-9-carboxamide Formula: C43H48N4O2 MolecularWeight: 652.86682

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=CC=CC=C3C2(CCCCC4(C5=CC=CC=C5C6=CC=CC=C64)C(=O)NCC7=CC=CC=C7)N8CCNCC8

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=CC=CC=C3C2(CCCCC4(C5=CC=CC=C5C6=CC=CC=C64)C(=O)NCC7=CC=CC=C7)N8CCNCC8

InChI

InChI=1S/C43H48N4O2/c48-40-36-21-9-12-24-39(36)43(46-29-27-44-28-30-46,47(40)33-17-5-2-6-18-33)26-14-13-25-42(41(49)45-31-32-15-3-1-4-16-32)37-22-10-7-19-34(37)35-20-8-11-23-38(35)42/h1,3-4,7-12,15-16,19-24,33,44H,2,5-6,13-14,17-18,25-31H2,(H,45,49)