(1-cyanoindolizin-2-yl)methyl 2-[(2-methylphenyl)carbonylamino]ethanoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 2-[(2-methylphenyl)carbonylamino]ethanoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 2-[(2-methylbenzoyl)amino]acetate CAS Name: 2-[[(2-methylphenyl)-oxomethyl]amino]acetic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 2-[(2-methylbenzoyl)amino]acetate Traditional Name: 2-(o-toluoylamino)acetic 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=C1C(=O)NCC(=O)OCC2=CN3C=CC=CC3=C2C#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCC(=O)OCC2=CN3C=CC=CC3=C2C#N

InChI

InChI=1S/C20H17N3O3/c1-14-6-2-3-7-16(14)20(25)22-11-19(24)26-13-15-12-23-9-5-4-8-18(23)17(15)10-21/h2-9,12H,11,13H2,1H3,(H,22,25)