2-[[(E)-3-chloranylbut-2-enyl]amino]benzoic acid

Systemtic Name: 2-[[(E)-3-chloranylbut-2-enyl]amino]benzoic acid Openeye Name: 2-[[(E)-3-chlorobut-2-enyl]amino]benzoic acid CAS Name: 2-[[(E)-3-chlorobut-2-enyl]amino]benzoic acid IUPAC Name: 2-[[(E)-3-chlorobut-2-enyl]amino]benzoic acid Traditional Name: 2-[[(E)-3-chlorobut-2-enyl]amino]benzoic acid Formula: C11H12ClNO2 MolecularWeight: 225.67148

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCNC1=CC=CC=C1C(=O)O)Cl

Isomeric SMILES

C/C(=C\CNC1=CC=CC=C1C(=O)O)/Cl

InChI

InChI=1S/C11H12ClNO2/c1-8(12)6-7-13-10-5-3-2-4-9(10)11(14)15/h2-6,13H,7H2,1H3,(H,14,15)/b8-6+