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3-[3-[(5-methylpyrimidin-2-yl)-(phenylmethyl)amino]propoxy]quinoxaline-2-carboxylic acid
3-[3-[(5-methylpyrimidin-2-yl)-(phenylmethyl)amino]propoxy]quinoxaline-2-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CN=C(N=C1)N(CCCOC2=NC3=CC=CC=C3N=C2C(=O)O)CC4=CC=CC=C4
Isomeric SMILES
CC1=CN=C(N=C1)N(CCCOC2=NC3=CC=CC=C3N=C2C(=O)O)CC4=CC=CC=C4
InChI
InChI=1S/C24H23N5O3/c1-17-14-25-24(26-15-17)29(16-18-8-3-2-4-9-18)12-7-13-32-22-21(23(30)31)27-19-10-5-6-11-20(19)28-22/h2-6,8-11,14-15H,7,12-13,16H2,1H3,(H,30,31)
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