2-azanyl-5-[cyano(phenyl)methoxy]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-5-[cyano(phenyl)methoxy]-5-oxidanylidene-pentanoic acid Openeye Name: 2-amino-5-[cyano(phenyl)methoxy]-5-oxo-pentanoic acid CAS Name: 2-amino-5-[cyano(phenyl)methoxy]-5-oxopentanoic acid IUPAC Name: 2-amino-5-[cyano(phenyl)methoxy]-5-oxopentanoic acid Traditional Name: 2-amino-5-[cyano(phenyl)methoxy]-5-keto-valeric acid Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)OC(=O)CCC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)C(C#N)OC(=O)CCC(C(=O)O)N

InChI

InChI=1S/C13H14N2O4/c14-8-11(9-4-2-1-3-5-9)19-12(16)7-6-10(15)13(17)18/h1-5,10-11H,6-7,15H2,(H,17,18)