2-(2,3-dicyanopropylamino)-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: 2-(2,3-dicyanopropylamino)-3-(4-hydroxyphenyl)propanoic acid Openeye Name: 2-(2,3-dicyanopropylamino)-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-(2,3-dicyanopropylamino)-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-(2,3-dicyanopropylamino)-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-(2,3-dicyanopropylamino)-3-(4-hydroxyphenyl)propionic acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)NCC(CC#N)C#N)O

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)NCC(CC#N)C#N)O

InChI

InChI=1S/C14H15N3O3/c15-6-5-11(8-16)9-17-13(14(19)20)7-10-1-3-12(18)4-2-10/h1-4,11,13,17-18H,5,7,9H2,(H,19,20)