3-[1-(1,3-benzodioxol-5-ylcarbonyl)-2-methyl-indolizin-3-yl]propanenitrile

Systemtic Name: 3-[1-(1,3-benzodioxol-5-ylcarbonyl)-2-methyl-indolizin-3-yl]propanenitrile Openeye Name: 3-[1-(1,3-benzodioxole-5-carbonyl)-2-methyl-indolizin-3-yl]propanenitrile CAS Name: 3-[1-[1,3-benzodioxol-5-yl(oxo)methyl]-2-methyl-3-indolizinyl]propanenitrile IUPAC Name: 3-[1-(1,3-benzodioxole-5-carbonyl)-2-methylindolizin-3-yl]propanenitrile Traditional Name: 3-(2-methyl-1-piperonyloyl-indolizin-3-yl)propionitrile Formula: C20H16N2O3 MolecularWeight: 332.35264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C=CC=CC2=C1C(=O)C3=CC4=C(C=C3)OCO4)CCC#N

Isomeric SMILES

CC1=C(N2C=CC=CC2=C1C(=O)C3=CC4=C(C=C3)OCO4)CCC#N

InChI

InChI=1S/C20H16N2O3/c1-13-15(6-4-9-21)22-10-3-2-5-16(22)19(13)20(23)14-7-8-17-18(11-14)25-12-24-17/h2-3,5,7-8,10-11H,4,6,12H2,1H3