N-(2-oxidanylbutyl)-2-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-1,3-oxazole-4-carboxamide

Systemtic Name: N-(2-oxidanylbutyl)-2-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-[[4-[(E)-cinnamyl]piperazin-1-yl]methyl]-N-(2-hydroxybutyl)oxazole-4-carboxamide CAS Name: N-(2-hydroxybutyl)-2-[[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methyl]-4-oxazolecarboxamide IUPAC Name: N-(2-hydroxybutyl)-2-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-1,3-oxazole-4-carboxamide Traditional Name: 2-[[4-[(E)-cinnamyl]piperazino]methyl]-N-(2-hydroxybutyl)oxazole-4-carboxamide Formula: C22H30N4O3 MolecularWeight: 398.4986

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1=COC(=N1)CN2CCN(CC2)CC=CC3=CC=CC=C3)O

Isomeric SMILES

CCC(CNC(=O)C1=COC(=N1)CN2CCN(CC2)C/C=C/C3=CC=CC=C3)O

InChI

InChI=1S/C22H30N4O3/c1-2-19(27)15-23-22(28)20-17-29-21(24-20)16-26-13-11-25(12-14-26)10-6-9-18-7-4-3-5-8-18/h3-9,17,19,27H,2,10-16H2,1H3,(H,23,28)/b9-6+