ethyl 2-acetamido-2-cyano-3-(1H-pyrrol-2-yl)propanoate

Systemtic Name: ethyl 2-acetamido-2-cyano-3-(1H-pyrrol-2-yl)propanoate Openeye Name: ethyl 2-acetamido-2-cyano-3-(1H-pyrrol-2-yl)propanoate CAS Name: 2-acetamido-2-cyano-3-(1H-pyrrol-2-yl)propanoic acid ethyl ester IUPAC Name: ethyl 2-acetamido-2-cyano-3-(1H-pyrrol-2-yl)propanoate Traditional Name: 2-acetamido-2-cyano-3-(1H-pyrrol-2-yl)propionic acid ethyl ester Formula: C12H15N3O3 MolecularWeight: 249.2658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CN1)(C#N)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=CN1)(C#N)NC(=O)C

InChI

InChI=1S/C12H15N3O3/c1-3-18-11(17)12(8-13,15-9(2)16)7-10-5-4-6-14-10/h4-6,14H,3,7H2,1-2H3,(H,15,16)