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2-Amino-3-cyano-7-dimethylamino-4-(5-(4-chlorophenyl)-isoxazol-3-yl)-4H-chromene
SpectraBase Compound ID IFdOt8A2DmQ
InChI InChI=1S/C21H17ClN4O2/c1-26(2)14-7-8-15-19(9-14)27-21(24)16(11-23)20(15)17-10-18(28-25-17)12-3-5-13(22)6-4-12/h3-10,20H,24H2,1-2H3
InChIKey VUBQAEOWJRNBHB-UHFFFAOYSA-N
Mol Weight 392.85 g/mol
Molecular Formula C21H17ClN4O2
Exact Mass 392.104004 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Vpw24gSrgZ
Name 2-Amino-3-cyano-7-dimethylamino-4-(5-(4-chlorophenyl)-isoxazol-3-yl)-4H-chromene
Alternate Name(s) 2-Amino-4-(5-(4-chlorophenyl)isoxazol-3-yl)-7-(dimethylamino)-4H-chromene-3-carbonitrile 2-Amino-4-[5-(4-chlorophenyl)-3-isoxazolyl]-7-(dimethylamino)-4H-1-benzopyran-3-carbonitrile 2-Amino-4-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-7-(dimethylamino)-4H-chromene-3-carbonitrile 2-Azanyl-4-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-7-(dimethylamino)-4H-chromene-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17ClN4O2
InChI InChI=1S/C21H17ClN4O2/c1-26(2)14-7-8-15-19(9-14)27-21(24)16(11-23)20(15)17-10-18(28-25-17)12-3-5-13(22)6-4-12/h3-10,20H,24H2,1-2H3
InChIKey VUBQAEOWJRNBHB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.201100345
Molecular Weight 392.846 g/mol
SMILES NC1=C(C(c2ccc(cc2O1)N(C)C)c1noc(c1)-c1ccc(cc1)Cl)C#N
SPLASH splash10-03di-0779000000-bbee2385eb51722c3cc1
Source of Spectrum APC-345-390-7e
Wiley ID 1769380