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2-Amino-1-(2-chloro-4-nitro-phenyl)-4-[4-(diethylamino)phenyl]-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile
SpectraBase Compound ID GdbrvGyKKNQ
InChI InChI=1S/C26H26ClN5O3/c1-3-30(4-2)17-10-8-16(9-11-17)24-19(15-28)26(29)31(22-6-5-7-23(33)25(22)24)21-13-12-18(32(34)35)14-20(21)27/h8-14,24H,3-7,29H2,1-2H3
InChIKey PIHYIMDEFWXBLH-UHFFFAOYSA-N
Mol Weight 491.98 g/mol
Molecular Formula C26H26ClN5O3
Exact Mass 491.172417 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7upO4srXBc1
Name 2-Amino-1-(2-chloro-4-nitro-phenyl)-4-[4-(diethylamino)phenyl]-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile
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Formula C26H26ClN5O3
InChI InChI=1S/C26H26ClN5O3/c1-3-30(4-2)17-10-8-16(9-11-17)24-19(15-28)26(29)31(22-6-5-7-23(33)25(22)24)21-13-12-18(32(34)35)14-20(21)27/h8-14,24H,3-7,29H2,1-2H3
InChIKey PIHYIMDEFWXBLH-UHFFFAOYSA-N
Molecular Weight 491.979 g/mol
SMILES NC=1N(c2c(cc(N(=O)=O)cc2)Cl)C2=C(C(C1C#N)c1ccc(cc1)N(CC)CC)C(=O)CCC2
SPLASH splash10-003r-7910000000-cb4cf3c6719ac7dc9677
Synonyms 2-Amino-1-(2-chloro-4-nitro-phenyl)-4-[4-(diethylamino)phenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile 2-Azanyl-1-(2-chloranyl-4-nitro-phenyl)-4-[4-(diethylamino)phenyl]-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Wiley ID 1448159