4-[[[(E)-but-2-enyl]amino]methyl]benzoic acid

Systemtic Name: 4-[[[(E)-but-2-enyl]amino]methyl]benzoic acid Openeye Name: 4-[[[(E)-but-2-enyl]amino]methyl]benzoic acid CAS Name: 4-[[[(E)-but-2-enyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[(E)-but-2-enyl]amino]methyl]benzoic acid Traditional Name: 4-[[[(E)-but-2-enyl]amino]methyl]benzoic acid Formula: C12H15NO2 MolecularWeight: 205.253

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCNCC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

C/C=C/CNCC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C12H15NO2/c1-2-3-8-13-9-10-4-6-11(7-5-10)12(14)15/h2-7,13H,8-9H2,1H3,(H,14,15)/b3-2+