(1-cyanoindolizin-2-yl)methyl 2-acetamido-3-methyl-benzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 2-acetamido-3-methyl-benzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 2-acetamido-3-methyl-benzoate CAS Name: 2-acetamido-3-methylbenzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 2-acetamido-3-methylbenzoate Traditional Name: 2-acetamido-3-methyl-benzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NC(=O)C)C(=O)OCC2=CN3C=CC=CC3=C2C#N

Isomeric SMILES

CC1=CC=CC(=C1NC(=O)C)C(=O)OCC2=CN3C=CC=CC3=C2C#N

InChI

InChI=1S/C20H17N3O3/c1-13-6-5-7-16(19(13)22-14(2)24)20(25)26-12-15-11-23-9-4-3-8-18(23)17(15)10-21/h3-9,11H,12H2,1-2H3,(H,22,24)