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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]octan-1-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]octan-1-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-4-imidazolyl)methyl]-1-octanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenylimidazol-4-yl)methyl]octan-1-amine Traditional Name: (3-butyl-2-phenyl-imidazol-4-yl)methyl-octyl-piperonyl-amine Formula: C30H41N3O2 MolecularWeight: 475.66544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CC1=CC2=C(C=C1)OCO2)CC3=CN=C(N3CCCC)C4=CC=CC=C4

Isomeric SMILES

CCCCCCCCN(CC1=CC2=C(C=C1)OCO2)CC3=CN=C(N3CCCC)C4=CC=CC=C4

InChI

InChI=1S/C30H41N3O2/c1-3-5-7-8-9-13-18-32(22-25-16-17-28-29(20-25)35-24-34-28)23-27-21-31-30(33(27)19-6-4-2)26-14-11-10-12-15-26/h10-12,14-17,20-21H,3-9,13,18-19,22-24H2,1-2H3