2-[4-[(E)-3-(3-bromophenyl)prop-2-enoyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[(E)-3-(3-bromophenyl)prop-2-enoyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[(E)-3-(3-bromophenyl)prop-2-enoyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[(E)-3-(3-bromophenyl)-1-oxoprop-2-enyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[(E)-3-(3-bromophenyl)prop-2-enoyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[(E)-3-(3-bromophenyl)acryloyl]piperazino]acetic acid Formula: C15H17BrN2O3 MolecularWeight: 353.21108

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C(=O)C=CC2=CC(=CC=C2)Br

Isomeric SMILES

C1CN(CCN1CC(=O)O)C(=O)/C=C/C2=CC(=CC=C2)Br

InChI

InChI=1S/C15H17BrN2O3/c16-13-3-1-2-12(10-13)4-5-14(19)18-8-6-17(7-9-18)11-15(20)21/h1-5,10H,6-9,11H2,(H,20,21)/b5-4+