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Amb10071869

Duplicate ID
CAS Number 1000018-71-2
Molecule Name Ethyl 3-nitro-4-(4-methylpiperazin-1-yl)benzoate
ETHYL 3-NITRO-4-(4-METHYLPIPERAZIN-1-YL)BENZOATE
Ethyl 4-(4-methylpiperazin-1-yl)-3-nitrobenzoate
SmilesCCOC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)C
InchiKeySHIZECNQEQRLRD-UHFFFAOYSA-N
InChi InChI=1S/C14H19N3O4/c1-3-21-14(18)11-4-5-12(13(10-11)17(19)20)16-8-6-15(2)7-9-16/h4-5,10H,3,6-9H2,1-2H3
Formula C14H19N3O4
Molecular weight 293.318
Rings 2
logP 2.0494
PSA 78.6
MR 87.6105
Building Block
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