(1-cyanoindolizin-2-yl)methyl 2,5-dimethylbenzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 2,5-dimethylbenzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 2,5-dimethylbenzoate CAS Name: 2,5-dimethylbenzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 2,5-dimethylbenzoate Traditional Name: 2,5-dimethylbenzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C19H16N2O2 MolecularWeight: 304.34254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)OCC2=CN3C=CC=CC3=C2C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)OCC2=CN3C=CC=CC3=C2C#N

InChI

InChI=1S/C19H16N2O2/c1-13-6-7-14(2)16(9-13)19(22)23-12-15-11-21-8-4-3-5-18(21)17(15)10-20/h3-9,11H,12H2,1-2H3