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1-(4-Nitrophenyl)-N'-(benzylidene)-9H-pyrido[3,4-b]indole-3-carbohydrazide

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1-(4-Nitrophenyl)-N'-(benzylidene)-9H-pyrido[3,4-b]indole-3-carbohydrazide
SpectraBase Compound ID E4ngVij8Kki
InChI InChI=1S/C25H17N5O3/c31-25(29-26-15-16-6-2-1-3-7-16)22-14-20-19-8-4-5-9-21(19)27-24(20)23(28-22)17-10-12-18(13-11-17)30(32)33/h1-15,27H,(H,29,31)
InChIKey ITVMYWDLPJZLKV-UHFFFAOYSA-N
Mol Weight 435.44 g/mol
Molecular Formula C25H17N5O3
Exact Mass 435.133139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9hP9pHrJKjK
Name 1-(4-Nitrophenyl)-N'-(benzylidene)-9H-pyrido[3,4-B]indole-3-carbohydrazide
Comments Computed using HOSE algorithm
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Exact Mass 435.133139424 u
Formula C25H17N5O3
InChI InChI=1S/C25H17N5O3/c31-25(29-26-15-16-6-2-1-3-7-16)22-14-20-19-8-4-5-9-21(19)27-24(20)23(28-22)17-10-12-18(13-11-17)30(32)33/h1-15,27H,(H,29,31)
InChIKey ITVMYWDLPJZLKV-UHFFFAOYSA-N
Molecular Weight 435.443 g/mol
SMILES C12=C(C3=CC=CC=C3N2)C=C(N=C1C1=CC=C(N(=O)=O)C=C1)C(NN=CC1=CC=CC=C1)=O