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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]butan-1-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]butan-1-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-4-imidazolyl)methyl]-1-butanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenylimidazol-4-yl)methyl]butan-1-amine Traditional Name: butyl-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-piperonyl-amine Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33N3O2/c1-3-5-14-28(18-21-12-13-24-25(16-21)31-20-30-24)19-23-17-27-26(29(23)15-6-4-2)22-10-8-7-9-11-22/h7-13,16-17H,3-6,14-15,18-20H2,1-2H3