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6-Amino-4-(3,4-dimethoxyphenyl)-3-(4-ethoxy-3-methoxyphenyl)-1,4-dihydropyrano[2,3-C]pyrazole-5-carbonitrile
SpectraBase Compound ID 2oSnvT5E0YY
InChI InChI=1S/C24H24N4O5/c1-5-32-17-9-7-14(11-19(17)31-4)22-21-20(13-6-8-16(29-2)18(10-13)30-3)15(12-25)23(26)33-24(21)28-27-22/h6-11,20H,5,26H2,1-4H3,(H,27,28)
InChIKey TXUVRVKOLJJNCY-UHFFFAOYSA-N
Mol Weight 448.48 g/mol
Molecular Formula C24H24N4O5
Exact Mass 448.17467 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2hrqntQiHQR
Name 6-Amino-4-(3,4-dimethoxyphenyl)-3-(4-ethoxy-3-methoxyphenyl)-1,4-dihydropyrano[2,3-C]pyrazole-5-carbonitrile
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 448.174669884 u
Formula C24H24N4O5
InChI InChI=1S/C24H24N4O5/c1-5-32-17-9-7-14(11-19(17)31-4)22-21-20(13-6-8-16(29-2)18(10-13)30-3)15(12-25)23(26)33-24(21)28-27-22/h6-11,20H,5,26H2,1-4H3,(H,27,28)
InChIKey TXUVRVKOLJJNCY-UHFFFAOYSA-N
Molecular Weight 448.479 g/mol
SMILES NC1=C(C(C2=C(O1)NN=C2C=1C=C(OC)C(=CC1)OCC)C1=CC(OC)=C(C=C1)OC)C#N