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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-1-phenyl-ethanamine Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-1-phenyl-ethanamine CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[(3-butyl-2-phenyl-4-imidazolyl)methyl]-1-phenylethanamine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[(3-butyl-2-phenylimidazol-4-yl)methyl]-1-phenylethanamine Traditional Name: [2-(1,3-benzodioxol-5-yl)-1-phenyl-ethyl]-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]amine Formula: C29H31N3O2 MolecularWeight: 453.57534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H31N3O2/c1-2-3-16-32-25(20-31-29(32)24-12-8-5-9-13-24)19-30-26(23-10-6-4-7-11-23)17-22-14-15-27-28(18-22)34-21-33-27/h4-15,18,20,26,30H,2-3,16-17,19,21H2,1H3