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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[[3-butyl-5-(4-ethoxyphenyl)-2-phenyl-imidazol-4-yl]methyl]-1-(3-ethoxyphenyl)methanamine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[[3-butyl-5-(4-ethoxyphenyl)-2-phenyl-imidazol-4-yl]methyl]-1-(3-ethoxyphenyl)methanamine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[[3-butyl-5-(4-ethoxyphenyl)-2-phenyl-4-imidazolyl]methyl]-1-(3-ethoxyphenyl)methanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[[3-butyl-5-(4-ethoxyphenyl)-2-phenylimidazol-4-yl]methyl]-1-(3-ethoxyphenyl)methanamine Traditional Name: (3-butyl-2-phenyl-5-p-phenetyl-imidazol-4-yl)methyl-(3-ethoxybenzyl)-piperonyl-amine Formula: C39H43N3O4 MolecularWeight: 617.77642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)OCC)CN(CC4=CC(=CC=C4)OCC)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CCCCN1C(=C(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)OCC)CN(CC4=CC(=CC=C4)OCC)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C39H43N3O4/c1-4-7-22-42-35(38(31-17-19-33(20-18-31)43-5-2)40-39(42)32-13-9-8-10-14-32)27-41(25-29-12-11-15-34(23-29)44-6-3)26-30-16-21-36-37(24-30)46-28-45-36/h8-21,23-24H,4-7,22,25-28H2,1-3H3