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Dimethyl 6-Amino-1-benzyl-5-cyano-1,4-dihydro-4-(3-hydroxyphenyl)pyridine-2,3-dicarboxylate
SpectraBase Compound ID KTrZQrrZ4y4
InChI InChI=1S/C23H21N3O5/c1-30-22(28)19-18(15-9-6-10-16(27)11-15)17(12-24)21(25)26(20(19)23(29)31-2)13-14-7-4-3-5-8-14/h3-11,18,27H,13,25H2,1-2H3
InChIKey VVGOKNXEEXPRNL-UHFFFAOYSA-N
Mol Weight 419.44 g/mol
Molecular Formula C23H21N3O5
Exact Mass 419.148121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rxjtqAq7U0
Name Dimethyl 6-Amino-1-benzyl-5-cyano-1,4-dihydro-4-(3-hydroxyphenyl)pyridine-2,3-dicarboxylate
Alternate Name(s) Dimethyl 6-amino-1-benzyl-5-cyano-4-(3-hydroxyphenyl)-1,4-dihydropyridine-2,3-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H21N3O5
InChI InChI=1S/C23H21N3O5/c1-30-22(28)19-18(15-9-6-10-16(27)11-15)17(12-24)21(25)26(20(19)23(29)31-2)13-14-7-4-3-5-8-14/h3-11,18,27H,13,25H2,1-2H3
InChIKey VVGOKNXEEXPRNL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201000228
Molecular Weight 419.437 g/mol
SMILES NC=1N(C(=C(C(c2cc(ccc2)O)C1C#N)C(=O)OC)C(=O)OC)Cc1ccccc1
SPLASH splash10-02bf-6009400000-513de4c82a8b1b7261a7
Source of Spectrum H-94-387-5e
Wiley ID 1785969