2-(5-bromanyl-2-methoxy-phenyl)-2-piperidin-1-yl-ethanoic acid

Systemtic Name: 2-(5-bromanyl-2-methoxy-phenyl)-2-piperidin-1-yl-ethanoic acid Openeye Name: 2-(5-bromo-2-methoxy-phenyl)-2-(1-piperidyl)acetic acid CAS Name: 2-(5-bromo-2-methoxyphenyl)-2-(1-piperidinyl)acetic acid IUPAC Name: 2-(5-bromo-2-methoxyphenyl)-2-piperidin-1-ylacetic acid Traditional Name: 2-(5-bromo-2-methoxy-phenyl)-2-piperidino-acetic acid Formula: C14H18BrNO3 MolecularWeight: 328.20162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(C(=O)O)N2CCCCC2

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(C(=O)O)N2CCCCC2

InChI

InChI=1S/C14H18BrNO3/c1-19-12-6-5-10(15)9-11(12)13(14(17)18)16-7-3-2-4-8-16/h5-6,9,13H,2-4,7-8H2,1H3,(H,17,18)