N-[3-(2-butylpiperidin-1-yl)propyl]-2-[(3-fluorophenyl)methyl]-3-oxidanylidene-1H-isoindole-5-carboxamide

Systemtic Name: N-[3-(2-butylpiperidin-1-yl)propyl]-2-[(3-fluorophenyl)methyl]-3-oxidanylidene-1H-isoindole-5-carboxamide Openeye Name: N-[3-(2-butyl-1-piperidyl)propyl]-2-[(3-fluorophenyl)methyl]-3-oxo-isoindoline-5-carboxamide CAS Name: N-[3-(2-butyl-1-piperidinyl)propyl]-2-[(3-fluorophenyl)methyl]-3-oxo-1H-isoindole-5-carboxamide IUPAC Name: N-[3-(2-butylpiperidin-1-yl)propyl]-2-[(3-fluorophenyl)methyl]-3-oxo-1H-isoindole-5-carboxamide Traditional Name: N-[3-(2-butylpiperidino)propyl]-2-(3-fluorobenzyl)-3-keto-isoindoline-5-carboxamide Formula: C28H36FN3O2 MolecularWeight: 465.602743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCCCN1CCCNC(=O)C2=CC3=C(CN(C3=O)CC4=CC(=CC=C4)F)C=C2

Isomeric SMILES

CCCCC1CCCCN1CCCNC(=O)C2=CC3=C(CN(C3=O)CC4=CC(=CC=C4)F)C=C2

InChI

InChI=1S/C28H36FN3O2/c1-2-3-10-25-11-4-5-15-31(25)16-7-14-30-27(33)22-12-13-23-20-32(28(34)26(23)18-22)19-21-8-6-9-24(29)17-21/h6,8-9,12-13,17-18,25H,2-5,7,10-11,14-16,19-20H2,1H3,(H,30,33)