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2-Naphthalenecarboxamide, N-(2,3-dimethylphenyl)-3-hydroxy-4-[[2-methoxy-5-(phenylsulfonyl)phenyl]azo]-
SpectraBase Compound ID E5hdx9ci8Ay
InChI InChI=1S/C32H27N3O5S/c1-20-10-9-15-27(21(20)2)33-32(37)26-18-22-11-7-8-14-25(22)30(31(26)36)35-34-28-19-24(16-17-29(28)40-3)41(38,39)23-12-5-4-6-13-23/h4-19,36H,1-3H3,(H,33,37)/b35-34+
InChIKey JYRAOYMCKSVBCX-XAHDOWKMSA-N
Mol Weight 565.6 g/mol
Molecular Formula C32H27N3O5S
Exact Mass 565.167142 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CPh0JTp6oUe
Name 2-Naphthalenecarboxamide, N-(2,3-dimethylphenyl)-3-hydroxy-4-[[2-methoxy-5-(phenylsulfonyl)phenyl]azo]-; 5-phenylsulfonyl-o-anisidine->3-hydroxy-2-naphtho-2,3-xylidide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 565.167142150 u
Formula C32H27N3O5S
InChI InChI=1S/C32H27N3O5S/c1-20-10-9-15-27(21(20)2)33-32(37)26-18-22-11-7-8-14-25(22)30(31(26)36)35-34-28-19-24(16-17-29(28)40-3)41(38,39)23-12-5-4-6-13-23/h4-19,36H,1-3H3,(H,33,37)/b35-34+
InChIKey JYRAOYMCKSVBCX-XAHDOWKMSA-N
Molecular Weight 565.644 g/mol
SMILES N(C(C1=CC2=C(C(=C1O)\N=N\C=1C(=CC=C(C1)S(=O)(=O)C1=CC=CC=C1)OC)C=CC=C2)=O)C1=C(C(=CC=C1)C)C