1-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]pipecolinic acid Formula: C15H18BrNO4 MolecularWeight: 356.21172

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)CC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

C1CCN(C(C1)C(=O)O)CC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C15H18BrNO4/c16-11-8-14-13(20-5-6-21-14)7-10(11)9-17-4-2-1-3-12(17)15(18)19/h7-8,12H,1-6,9H2,(H,18,19)