2-chloranyl-6-(4-ethanoylpiperazin-1-yl)benzoic acid

Systemtic Name: 2-chloranyl-6-(4-ethanoylpiperazin-1-yl)benzoic acid Openeye Name: 2-(4-acetylpiperazin-1-yl)-6-chloro-benzoic acid CAS Name: 2-(4-acetyl-1-piperazinyl)-6-chlorobenzoic acid IUPAC Name: 2-(4-acetylpiperazin-1-yl)-6-chlorobenzoic acid Traditional Name: 2-(4-acetylpiperazino)-6-chloro-benzoic acid Formula: C13H15ClN2O3 MolecularWeight: 282.7228

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C(=CC=C2)Cl)C(=O)O

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C(=CC=C2)Cl)C(=O)O

InChI

InChI=1S/C13H15ClN2O3/c1-9(17)15-5-7-16(8-6-15)11-4-2-3-10(14)12(11)13(18)19/h2-4H,5-8H2,1H3,(H,18,19)