2-[1,3-benzodioxol-5-ylmethyl-[2-(4-imidazol-1-ylphenoxy)ethyl]amino]-N-butyl-ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl-[2-(4-imidazol-1-ylphenoxy)ethyl]amino]-N-butyl-ethanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl-[2-(4-imidazol-1-ylphenoxy)ethyl]amino]-N-butyl-acetamide CAS Name: 2-[1,3-benzodioxol-5-ylmethyl-[2-[4-(1-imidazolyl)phenoxy]ethyl]amino]-N-butylacetamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl-[2-(4-imidazol-1-ylphenoxy)ethyl]amino]-N-butylacetamide Traditional Name: N-butyl-2-[2-(4-imidazol-1-ylphenoxy)ethyl-piperonyl-amino]acetamide Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN(CCOC1=CC=C(C=C1)N2C=CN=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCNC(=O)CN(CCOC1=CC=C(C=C1)N2C=CN=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H30N4O4/c1-2-3-10-27-25(30)17-28(16-20-4-9-23-24(15-20)33-19-32-23)13-14-31-22-7-5-21(6-8-22)29-12-11-26-18-29/h4-9,11-12,15,18H,2-3,10,13-14,16-17,19H2,1H3,(H,27,30)