3-[1-(2,3-dimethylphenyl)carbonyl-2-methyl-indolizin-3-yl]propanenitrile

Systemtic Name: 3-[1-(2,3-dimethylphenyl)carbonyl-2-methyl-indolizin-3-yl]propanenitrile Openeye Name: 3-[1-(2,3-dimethylbenzoyl)-2-methyl-indolizin-3-yl]propanenitrile CAS Name: 3-[1-[(2,3-dimethylphenyl)-oxomethyl]-2-methyl-3-indolizinyl]propanenitrile IUPAC Name: 3-[1-(2,3-dimethylbenzoyl)-2-methylindolizin-3-yl]propanenitrile Traditional Name: 3-[1-(2,3-dimethylbenzoyl)-2-methyl-indolizin-3-yl]propionitrile Formula: C21H20N2O MolecularWeight: 316.3963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1C)C(=O)C2=C3C=CC=CN3C(=C2C)CCC#N

Isomeric SMILES

CC1=CC=CC(=C1C)C(=O)C2=C3C=CC=CN3C(=C2C)CCC#N

InChI

InChI=1S/C21H20N2O/c1-14-8-6-9-17(15(14)2)21(24)20-16(3)18(11-7-12-22)23-13-5-4-10-19(20)23/h4-6,8-10,13H,7,11H2,1-3H3