2-cyano-3-[4-(diethylamino)phenyl]propanoic acid

Systemtic Name: 2-cyano-3-[4-(diethylamino)phenyl]propanoic acid Openeye Name: 2-cyano-3-[4-(diethylamino)phenyl]propanoic acid CAS Name: 2-cyano-3-[4-(diethylamino)phenyl]propanoic acid IUPAC Name: 2-cyano-3-[4-(diethylamino)phenyl]propanoic acid Traditional Name: 2-cyano-3-[4-(diethylamino)phenyl]propionic acid Formula: C14H18N2O2 MolecularWeight: 246.30492

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)CC(C#N)C(=O)O

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)CC(C#N)C(=O)O

InChI

InChI=1S/C14H18N2O2/c1-3-16(4-2)13-7-5-11(6-8-13)9-12(10-15)14(17)18/h5-8,12H,3-4,9H2,1-2H3,(H,17,18)