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Amb10071864

Duplicate ID
CAS Number 1000018-70-1
Molecule Name 2-[3-(ethoxycarbonyl)piperidin-1-yl]-5-nitrobenzoic acid
2-[3-(Ethoxycarbonyl)piperidin-1-yl]-5-nitrobenzoic acid
SmilesCCOC(=O)C1CCCN(C1)c1ccc(cc1C(=O)O)[N+](=O)[O-]
InchiKeyNHEAJFNQCNBDTF-UHFFFAOYSA-N
InChi InChI=1S/C15H18N2O6/c1-2-23-15(20)10-4-3-7-16(9-10)13-6-5-11(17(21)22)8-12(13)14(18)19/h5-6,8,10H,2-4,7,9H2,1H3,(H,18,19)
Formula C15H18N2O6
Molecular weight 322.313
Rings 2
logP 2.6607
PSA 112.66
MR 87.3783
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