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1-[(3-bromophenyl)-(2-ethoxyphenyl)methyl]piperidine-2-carboxylic acid
1-[(3-bromophenyl)-(2-ethoxyphenyl)methyl]piperidine-2-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CCOC1=CC=CC=C1C(C2=CC(=CC=C2)Br)N3CCCCC3C(=O)O
Isomeric SMILES
CCOC1=CC=CC=C1C(C2=CC(=CC=C2)Br)N3CCCCC3C(=O)O
InChI
InChI=1S/C21H24BrNO3/c1-2-26-19-12-4-3-10-17(19)20(15-8-7-9-16(22)14-15)23-13-6-5-11-18(23)21(24)25/h3-4,7-10,12,14,18,20H,2,5-6,11,13H2,1H3,(H,24,25)
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