N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-2-(6-chloranyl-1,3-benzodioxol-5-yl)-1-phenyl-ethanamine

Systemtic Name: N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-2-(6-chloranyl-1,3-benzodioxol-5-yl)-1-phenyl-ethanamine Openeye Name: N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-2-(6-chloro-1,3-benzodioxol-5-yl)-1-phenyl-ethanamine CAS Name: N-[(3-butyl-2-phenyl-4-imidazolyl)methyl]-2-(6-chloro-1,3-benzodioxol-5-yl)-1-phenylethanamine IUPAC Name: N-[(3-butyl-2-phenylimidazol-4-yl)methyl]-2-(6-chloro-1,3-benzodioxol-5-yl)-1-phenylethanamine Traditional Name: (3-butyl-2-phenyl-imidazol-4-yl)methyl-[2-(6-chloro-1,3-benzodioxol-5-yl)-1-phenyl-ethyl]amine Formula: C29H30ClN3O2 MolecularWeight: 488.0204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1C2=CC=CC=C2)CNC(CC3=CC4=C(C=C3Cl)OCO4)C5=CC=CC=C5

Isomeric SMILES

CCCCN1C(=CN=C1C2=CC=CC=C2)CNC(CC3=CC4=C(C=C3Cl)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C29H30ClN3O2/c1-2-3-14-33-24(19-32-29(33)22-12-8-5-9-13-22)18-31-26(21-10-6-4-7-11-21)15-23-16-27-28(17-25(23)30)35-20-34-27/h4-13,16-17,19,26,31H,2-3,14-15,18,20H2,1H3