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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-1-cyclopropyl-ethanamine Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-1-cyclopropyl-ethanamine CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[(3-butyl-2-phenyl-4-imidazolyl)methyl]-1-cyclopropylethanamine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[(3-butyl-2-phenylimidazol-4-yl)methyl]-1-cyclopropylethanamine Traditional Name: [2-(1,3-benzodioxol-5-yl)-1-cyclopropyl-ethyl]-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]amine Formula: C26H31N3O2 MolecularWeight: 417.54324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1C2=CC=CC=C2)CNC(CC3=CC4=C(C=C3)OCO4)C5CC5

Isomeric SMILES

CCCCN1C(=CN=C1C2=CC=CC=C2)CNC(CC3=CC4=C(C=C3)OCO4)C5CC5

InChI

InChI=1S/C26H31N3O2/c1-2-3-13-29-22(17-28-26(29)21-7-5-4-6-8-21)16-27-23(20-10-11-20)14-19-9-12-24-25(15-19)31-18-30-24/h4-9,12,15,17,20,23,27H,2-3,10-11,13-14,16,18H2,1H3