2-[[3-cyano-5-oxidanylidene-1-(phenylmethyl)-2H-pyrrol-4-yl]amino]ethanoic acid

Systemtic Name: 2-[[3-cyano-5-oxidanylidene-1-(phenylmethyl)-2H-pyrrol-4-yl]amino]ethanoic acid Openeye Name: 2-[(1-benzyl-3-cyano-5-oxo-2H-pyrrol-4-yl)amino]acetic acid CAS Name: 2-[[3-cyano-5-oxo-1-(phenylmethyl)-2H-pyrrol-4-yl]amino]acetic acid IUPAC Name: 2-[(1-benzyl-3-cyano-5-oxo-2H-pyrrol-4-yl)amino]acetic acid Traditional Name: 2-[(1-benzyl-4-cyano-2-keto-3-pyrrolin-3-yl)amino]acetic acid Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(C(=O)N1CC2=CC=CC=C2)NCC(=O)O)C#N

Isomeric SMILES

C1C(=C(C(=O)N1CC2=CC=CC=C2)NCC(=O)O)C#N

InChI

InChI=1S/C14H13N3O3/c15-6-11-9-17(8-10-4-2-1-3-5-10)14(20)13(11)16-7-12(18)19/h1-5,16H,7-9H2,(H,18,19)