3-azanyl-4-(2-cyano-2,5-dihydropyrrol-1-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 3-azanyl-4-(2-cyano-2,5-dihydropyrrol-1-yl)-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-(2-cyano-2,5-dihydropyrrol-1-yl)-4-oxo-butanoic acid CAS Name: 3-amino-4-(2-cyano-2,5-dihydropyrrol-1-yl)-4-oxobutanoic acid IUPAC Name: 3-amino-4-(2-cyano-2,5-dihydropyrrol-1-yl)-4-oxobutanoic acid Traditional Name: 3-amino-4-(2-cyano-3-pyrrolin-1-yl)-4-keto-butyric acid Formula: C9H11N3O3 MolecularWeight: 209.20194

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(N1C(=O)C(CC(=O)O)N)C#N

Isomeric SMILES

C1C=CC(N1C(=O)C(CC(=O)O)N)C#N

InChI

InChI=1S/C9H11N3O3/c10-5-6-2-1-3-12(6)9(15)7(11)4-8(13)14/h1-2,6-7H,3-4,11H2,(H,13,14)