2-[6-(1H-imidazol-2-yl)-1,3-benzodioxol-4-yl]heptanamide

Systemtic Name: 2-[6-(1H-imidazol-2-yl)-1,3-benzodioxol-4-yl]heptanamide Openeye Name: 2-[6-(1H-imidazol-2-yl)-1,3-benzodioxol-4-yl]heptanamide CAS Name: 2-[6-(1H-imidazol-2-yl)-1,3-benzodioxol-4-yl]heptanamide IUPAC Name: 2-[6-(1H-imidazol-2-yl)-1,3-benzodioxol-4-yl]heptanamide Traditional Name: 2-[6-(1H-imidazol-2-yl)-1,3-benzodioxol-4-yl]enanthamide Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=C2C(=CC(=C1)C3=NC=CN3)OCO2)C(=O)N

Isomeric SMILES

CCCCCC(C1=C2C(=CC(=C1)C3=NC=CN3)OCO2)C(=O)N

InChI

InChI=1S/C17H21N3O3/c1-2-3-4-5-12(16(18)21)13-8-11(17-19-6-7-20-17)9-14-15(13)23-10-22-14/h6-9,12H,2-5,10H2,1H3,(H2,18,21)(H,19,20)