(E)-5-[4-(methylamino)phenyl]pent-2-en-4-ynoic acid

Systemtic Name: (E)-5-[4-(methylamino)phenyl]pent-2-en-4-ynoic acid Openeye Name: (E)-5-[4-(methylamino)phenyl]pent-2-en-4-ynoic acid CAS Name: (E)-5-[4-(methylamino)phenyl]pent-2-en-4-ynoic acid IUPAC Name: (E)-5-[4-(methylamino)phenyl]pent-2-en-4-ynoic acid Traditional Name: (E)-5-[4-(methylamino)phenyl]pent-2-en-4-ynoic acid Formula: C12H11NO2 MolecularWeight: 201.22124

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=C(C=C1)C#CC=CC(=O)O

Isomeric SMILES

CNC1=CC=C(C=C1)C#C/C=C/C(=O)O

InChI

InChI=1S/C12H11NO2/c1-13-11-8-6-10(7-9-11)4-2-3-5-12(14)15/h3,5-9,13H,1H3,(H,14,15)/b5-3+