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N-((1R,2S)-2,4-Dibenzoyl-1-naphthalen-1-yl-pent-4-enyl)-4-methyl-benzenesulfonamide

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N-((1R,2S)-2,4-Dibenzoyl-1-naphthalen-1-yl-pent-4-enyl)-4-methyl-benzenesulfonamide
SpectraBase Compound ID 2itDxEj85NC
InChI InChI=1S/C36H31NO4S/c1-25-20-22-30(23-21-25)42(40,41)37-34(32-19-11-17-27-12-9-10-18-31(27)32)33(36(39)29-15-7-4-8-16-29)24-26(2)35(38)28-13-5-3-6-14-28/h3-23,33-34,37H,2,24H2,1H3/t33-,34-/m0/s1
InChIKey YBQFZJPHCWLNDB-HEVIKAOCSA-N
Mol Weight 573.7 g/mol
Molecular Formula C36H31NO4S
Exact Mass 573.19738 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3M6JhQ4zIES
Name N-((1R,2S)-2,4-Dibenzoyl-1-naphthalen-1-yl-pent-4-enyl)-4-methyl-benzenesulfonamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 573.197379652 u
Formula C36H31NO4S
InChI InChI=1S/C36H31NO4S/c1-25-20-22-30(23-21-25)42(40,41)37-34(32-19-11-17-27-12-9-10-18-31(27)32)33(36(39)29-15-7-4-8-16-29)24-26(2)35(38)28-13-5-3-6-14-28/h3-23,33-34,37H,2,24H2,1H3/t33-,34-/m0/s1
InChIKey YBQFZJPHCWLNDB-HEVIKAOCSA-N
Molecular Weight 573.707 g/mol
SMILES [C@](NS(C=1C=CC(=CC1)C)(=O)=O)([C@@](C(=O)C1=CC=CC=C1)(CC(C(=O)C=1C=CC=CC1)=C)[H])(C=1C2=C(C=CC=C2)C=CC1)[H]