3-butyl-3-(9H-fluoren-9-yl)-1-oxidanylidene-2-piperazin-1-yl-isoindole-4-carboxamide

Systemtic Name: 3-butyl-3-(9H-fluoren-9-yl)-1-oxidanylidene-2-piperazin-1-yl-isoindole-4-carboxamide Openeye Name: 3-butyl-3-(9H-fluoren-9-yl)-1-oxo-2-piperazin-1-yl-isoindoline-4-carboxamide CAS Name: 3-butyl-3-(9H-fluoren-9-yl)-1-oxo-2-(1-piperazinyl)-4-isoindolecarboxamide IUPAC Name: 3-butyl-3-(9H-fluoren-9-yl)-1-oxo-2-piperazin-1-ylisoindole-4-carboxamide Traditional Name: 3-butyl-3-(9H-fluoren-9-yl)-1-keto-2-piperazino-isoindoline-4-carboxamide Formula: C30H32N4O2 MolecularWeight: 480.60068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C2=C(C=CC=C2C(=O)N)C(=O)N1N3CCNCC3)C4C5=CC=CC=C5C6=CC=CC=C46

Isomeric SMILES

CCCCC1(C2=C(C=CC=C2C(=O)N)C(=O)N1N3CCNCC3)C4C5=CC=CC=C5C6=CC=CC=C46

InChI

InChI=1S/C30H32N4O2/c1-2-3-15-30(26-22-11-6-4-9-20(22)21-10-5-7-12-23(21)26)27-24(28(31)35)13-8-14-25(27)29(36)34(30)33-18-16-32-17-19-33/h4-14,26,32H,2-3,15-19H2,1H3,(H2,31,35)