2-(1,3-benzodioxol-5-yl)-N-[[3-butyl-2-(3-fluorophenyl)imidazol-4-yl]methyl]-1-phenyl-ethanamine

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[[3-butyl-2-(3-fluorophenyl)imidazol-4-yl]methyl]-1-phenyl-ethanamine Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[[3-butyl-2-(3-fluorophenyl)imidazol-4-yl]methyl]-1-phenyl-ethanamine CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[[3-butyl-2-(3-fluorophenyl)-4-imidazolyl]methyl]-1-phenylethanamine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[[3-butyl-2-(3-fluorophenyl)imidazol-4-yl]methyl]-1-phenylethanamine Traditional Name: [2-(1,3-benzodioxol-5-yl)-1-phenyl-ethyl]-[[3-butyl-2-(3-fluorophenyl)imidazol-4-yl]methyl]amine Formula: C29H30FN3O2 MolecularWeight: 471.565803

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1C2=CC(=CC=C2)F)CNC(CC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

CCCCN1C(=CN=C1C2=CC(=CC=C2)F)CNC(CC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C29H30FN3O2/c1-2-3-14-33-25(19-32-29(33)23-10-7-11-24(30)17-23)18-31-26(22-8-5-4-6-9-22)15-21-12-13-27-28(16-21)35-20-34-27/h4-13,16-17,19,26,31H,2-3,14-15,18,20H2,1H3