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4-[(2,4-Dichlorophenyl)azo]-N-(1,3-dioxo-2-phenyl-5-isoindolinyl)-3-hydroxy-2-naphthamide
SpectraBase Compound ID 2y9q1ggSsso
InChI InChI=1S/C31H18Cl2N4O4/c32-18-10-13-26(25(33)15-18)35-36-27-21-9-5-4-6-17(21)14-24(28(27)38)29(39)34-19-11-12-22-23(16-19)31(41)37(30(22)40)20-7-2-1-3-8-20/h1-16,38H,(H,34,39)/b36-35+
InChIKey ZEGZTTKDNWDVEG-ULDVOPSXSA-N
Mol Weight 581.42 g/mol
Molecular Formula C31H18Cl2N4O4
Exact Mass 580.07051 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JxJQthqt45G
Name 4-[(2,4-Dichlorophenyl)azo]-N-(1,3-dioxo-2-phenyl-5-isoindolinyl)-3-hydroxy-2-naphthamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 580.070510472 u
Formula C31H18Cl2N4O4
InChI InChI=1S/C31H18Cl2N4O4/c32-18-10-13-26(25(33)15-18)35-36-27-21-9-5-4-6-17(21)14-24(28(27)38)29(39)34-19-11-12-22-23(16-19)31(41)37(30(22)40)20-7-2-1-3-8-20/h1-16,38H,(H,34,39)/b36-35+
InChIKey ZEGZTTKDNWDVEG-ULDVOPSXSA-N
Molecular Weight 581.415 g/mol
SMILES OC=1C(C(=O)NC2=CC=3C(N(C4=CC=CC=C4)C(C3C=C2)=O)=O)=CC=2C=CC=CC2C1\N=N\C1=CC=C(Cl)C=C1Cl