2-[4-[2-(4-bromophenyl)ethanoyl]piperazin-1-yl]carbonylcyclopropane-1-carboxylic acid

Systemtic Name: 2-[4-[2-(4-bromophenyl)ethanoyl]piperazin-1-yl]carbonylcyclopropane-1-carboxylic acid Openeye Name: 2-[4-[2-(4-bromophenyl)acetyl]piperazine-1-carbonyl]cyclopropanecarboxylic acid CAS Name: 2-[[4-[2-(4-bromophenyl)-1-oxoethyl]-1-piperazinyl]-oxomethyl]-1-cyclopropanecarboxylic acid IUPAC Name: 2-[4-[2-(4-bromophenyl)acetyl]piperazine-1-carbonyl]cyclopropane-1-carboxylic acid Traditional Name: 2-[4-[2-(4-bromophenyl)acetyl]piperazine-1-carbonyl]cyclopropanecarboxylic acid Formula: C17H19BrN2O4 MolecularWeight: 395.24776

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CC=C(C=C2)Br)C(=O)C3CC3C(=O)O

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CC=C(C=C2)Br)C(=O)C3CC3C(=O)O

InChI

InChI=1S/C17H19BrN2O4/c18-12-3-1-11(2-4-12)9-15(21)19-5-7-20(8-6-19)16(22)13-10-14(13)17(23)24/h1-4,13-14H,5-10H2,(H,23,24)