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1-[(3-bromophenyl)-(2,3,4-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid
1-[(3-bromophenyl)-(2,3,4-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
COC1=C(C(=C(C=C1)C(C2=CC(=CC=C2)Br)N3CCCC(C3)C(=O)O)OC)OC
Isomeric SMILES
COC1=C(C(=C(C=C1)C(C2=CC(=CC=C2)Br)N3CCCC(C3)C(=O)O)OC)OC
InChI
InChI=1S/C22H26BrNO5/c1-27-18-10-9-17(20(28-2)21(18)29-3)19(14-6-4-8-16(23)12-14)24-11-5-7-15(13-24)22(25)26/h4,6,8-10,12,15,19H,5,7,11,13H2,1-3H3,(H,25,26)
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