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3-[4-(bromomethyl)phenoxy]-2,6-bis(oxidanylidene)piperidine-3-carboxylic acid

3-[4-(bromomethyl)phenoxy]-2,6-bis(oxidanylidene)piperidine-3-carboxylic acid

Systemtic Name:3-[4-(bromomethyl)phenoxy]-2,6-bis(oxidanylidene)piperidine-3-carboxylic acid
Openeye Name:3-[4-(bromomethyl)phenoxy]-2,6-dioxo-piperidine-3-carboxylic acid
CAS Name:3-[4-(bromomethyl)phenoxy]-2,6-dioxo-3-piperidinecarboxylic acid
IUPAC Name:3-[4-(bromomethyl)phenoxy]-2,6-dioxopiperidine-3-carboxylic acid
Traditional Name:3-[4-(bromomethyl)phenoxy]-2,6-diketo-nipecotic acid
Formula: C13H12BrNO5
MolecularWeight: 342.14208
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)NC1=O)(C(=O)O)OC2=CC=C(C=C2)CBr


Isomeric SMILES

C1CC(C(=O)NC1=O)(C(=O)O)OC2=CC=C(C=C2)CBr


InChI

InChI=1S/C13H12BrNO5/c14-7-8-1-3-9(4-2-8)20-13(12(18)19)6-5-10(16)15-11(13)17/h1-4H,5-7H2,(H,18,19)(H,15,16,17)


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