(E)-3-[2-chloranyl-6-(4-ethanoylpiperazin-1-yl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-chloranyl-6-(4-ethanoylpiperazin-1-yl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-(4-acetylpiperazin-1-yl)-6-chloro-phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-(4-acetyl-1-piperazinyl)-6-chlorophenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(4-acetylpiperazin-1-yl)-6-chlorophenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-(4-acetylpiperazino)-6-chloro-phenyl]acrylic acid Formula: C15H17ClN2O3 MolecularWeight: 308.76008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17ClN2O3/c1-11(19)17-7-9-18(10-8-17)14-4-2-3-13(16)12(14)5-6-15(20)21/h2-6H,7-10H2,1H3,(H,20,21)/b6-5+