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1-[(2-bromophenyl)-(3,5-dimethylphenyl)methyl]piperidine-4-carboxylic acid
1-[(2-bromophenyl)-(3,5-dimethylphenyl)methyl]piperidine-4-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC(=CC(=C1)C(C2=CC=CC=C2Br)N3CCC(CC3)C(=O)O)C
Isomeric SMILES
CC1=CC(=CC(=C1)C(C2=CC=CC=C2Br)N3CCC(CC3)C(=O)O)C
InChI
InChI=1S/C21H24BrNO2/c1-14-11-15(2)13-17(12-14)20(18-5-3-4-6-19(18)22)23-9-7-16(8-10-23)21(24)25/h3-6,11-13,16,20H,7-10H2,1-2H3,(H,24,25)
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