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Amb8439820

Duplicate ID
Molecule Name N-Nornitidine, derivative of
SmilesCOc1cc2CNC3=C(c2cc1OC)CCc1c3cc2OCOc2c1
InchiKeyAULRHIHLNFTXIC-UHFFFAOYSA-N
InChi InChI=1S/C20H19NO4/c1-22-16-6-12-9-21-20-13(14(12)7-17(16)23-2)4-3-11-5-18-19(8-15(11)20)25-10-24-18/h5-8,21H,3-4,9-10H2,1-2H3
Formula C20H19NO4
Molecular weight 337.369
Rings 5
logP 3.679
PSA 48.95
MR 98.0867
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