(1-cyanoindolizin-2-yl)methyl 2,4,6-trimethylbenzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 2,4,6-trimethylbenzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 2,4,6-trimethylbenzoate CAS Name: 2,4,6-trimethylbenzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 2,4,6-trimethylbenzoate Traditional Name: 2,4,6-trimethylbenzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C20H18N2O2 MolecularWeight: 318.36912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N2O2/c1-13-8-14(2)19(15(3)9-13)20(23)24-12-16-11-22-7-5-4-6-18(22)17(16)10-21/h4-9,11H,12H2,1-3H3