3-[2-methyl-1-(3,4,5-triethoxyphenyl)carbonyl-indolizin-3-yl]propanenitrile

Systemtic Name: 3-[2-methyl-1-(3,4,5-triethoxyphenyl)carbonyl-indolizin-3-yl]propanenitrile Openeye Name: 3-[2-methyl-1-(3,4,5-triethoxybenzoyl)indolizin-3-yl]propanenitrile CAS Name: 3-[2-methyl-1-[oxo-(3,4,5-triethoxyphenyl)methyl]-3-indolizinyl]propanenitrile IUPAC Name: 3-[2-methyl-1-(3,4,5-triethoxybenzoyl)indolizin-3-yl]propanenitrile Traditional Name: 3-[2-methyl-1-(3,4,5-triethoxybenzoyl)indolizin-3-yl]propionitrile Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)C2=C3C=CC=CN3C(=C2C)CCC#N

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)C2=C3C=CC=CN3C(=C2C)CCC#N

InChI

InChI=1S/C25H28N2O4/c1-5-29-21-15-18(16-22(30-6-2)25(21)31-7-3)24(28)23-17(4)19(12-10-13-26)27-14-9-8-11-20(23)27/h8-9,11,14-16H,5-7,10,12H2,1-4H3