1-(6-bromanylhexanoyl)-4-[[3-(3-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-N-heptyl-piperidine-4-carboxamide

Systemtic Name: 1-(6-bromanylhexanoyl)-4-[[3-(3-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-N-heptyl-piperidine-4-carboxamide Openeye Name: 1-(6-bromohexanoyl)-4-[[3-(3-bromophenyl)-4,5-dihydroisoxazol-5-yl]methyl]-N-heptyl-piperidine-4-carboxamide CAS Name: 1-(6-bromo-1-oxohexyl)-4-[[3-(3-bromophenyl)-4,5-dihydroisoxazol-5-yl]methyl]-N-heptyl-4-piperidinecarboxamide IUPAC Name: 1-(6-bromohexanoyl)-4-[[3-(3-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-N-heptylpiperidine-4-carboxamide Traditional Name: 1-(6-bromohexanoyl)-4-[[3-(3-bromophenyl)-2-isoxazolin-5-yl]methyl]-N-heptyl-isonipecotamide Formula: C29H43Br2N3O3 MolecularWeight: 641.47802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)C1(CCN(CC1)C(=O)CCCCCBr)CC2CC(=NO2)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCCCCCNC(=O)C1(CCN(CC1)C(=O)CCCCCBr)CC2CC(=NO2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C29H43Br2N3O3/c1-2-3-4-5-9-17-32-28(36)29(14-18-34(19-15-29)27(35)13-7-6-8-16-30)22-25-21-26(33-37-25)23-11-10-12-24(31)20-23/h10-12,20,25H,2-9,13-19,21-22H2,1H3,(H,32,36)