(E)-3-[2-chloranyl-6-(3-oxidanylidenepiperazin-1-yl)phenyl]prop-2-enoate

Systemtic Name: (E)-3-[2-chloranyl-6-(3-oxidanylidenepiperazin-1-yl)phenyl]prop-2-enoate Openeye Name: (E)-3-[2-chloro-6-(3-oxopiperazin-1-yl)phenyl]prop-2-enoate CAS Name: (E)-3-[2-chloro-6-(3-oxo-1-piperazinyl)phenyl]-2-propenoate IUPAC Name: (E)-3-[2-chloro-6-(3-oxopiperazin-1-yl)phenyl]prop-2-enoate Traditional Name: (E)-3-[2-chloro-6-(3-ketopiperazino)phenyl]acrylate Formula: C13H12ClN2O3- MolecularWeight: 279.69898

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=C(C(=CC=C2)Cl)C=CC(=O)[O-]

Isomeric SMILES

C1CN(CC(=O)N1)C2=C(C(=CC=C2)Cl)/C=C/C(=O)[O-]

InChI

InChI=1S/C13H13ClN2O3/c14-10-2-1-3-11(9(10)4-5-13(18)19)16-7-6-15-12(17)8-16/h1-5H,6-8H2,(H,15,17)(H,18,19)/p-1/b5-4+