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3-phenyl-3-[[4-[4-(pyridin-2-ylamino)butyl]phenyl]amino]propanoic acid
3-phenyl-3-[[4-[4-(pyridin-2-ylamino)butyl]phenyl]amino]propanoic acid
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC=C(C=C1)C(CC(=O)O)NC2=CC=C(C=C2)CCCCNC3=CC=CC=N3
Isomeric SMILES
C1=CC=C(C=C1)C(CC(=O)O)NC2=CC=C(C=C2)CCCCNC3=CC=CC=N3
InChI
InChI=1S/C24H27N3O2/c28-24(29)18-22(20-9-2-1-3-10-20)27-21-14-12-19(13-15-21)8-4-6-16-25-23-11-5-7-17-26-23/h1-3,5,7,9-15,17,22,27H,4,6,8,16,18H2,(H,25,26)(H,28,29)
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