N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-1-(2,3-dihydro-1-benzofuran-5-yl)methanamine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-1-(2,3-dihydro-1-benzofuran-5-yl)methanamine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-1-(2,3-dihydrobenzofuran-5-yl)methanamine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-4-imidazolyl)methyl]-1-(2,3-dihydrobenzofuran-5-yl)methanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenylimidazol-4-yl)methyl]-1-(2,3-dihydro-1-benzofuran-5-yl)methanamine Traditional Name: (3-butyl-2-phenyl-imidazol-4-yl)methyl-(coumaran-5-ylmethyl)-piperonyl-amine Formula: C31H33N3O3 MolecularWeight: 495.61202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1C2=CC=CC=C2)CN(CC3=CC4=C(C=C3)OCC4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CCCCN1C(=CN=C1C2=CC=CC=C2)CN(CC3=CC4=C(C=C3)OCC4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C31H33N3O3/c1-2-3-14-34-27(18-32-31(34)25-7-5-4-6-8-25)21-33(19-23-9-11-28-26(16-23)13-15-35-28)20-24-10-12-29-30(17-24)37-22-36-29/h4-12,16-18H,2-3,13-15,19-22H2,1H3