![2-Naphthalenecarboxamide, 1-hydroxy-N-[4-[(octadecylamino)sulfonyl]phenyl]-](/api/spectrum/BWRtKvcOo1k/structure.png?h=300&w=458 "2-Naphthalenecarboxamide, 1-hydroxy-N-[4-[(octadecylamino)sulfonyl]phenyl]-")
| SpectraBase Compound ID | ECYsvHak5mC |
|---|---|
| InChI | InChI=1S/C35H50N2O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-28-36-42(40,41)31-25-23-30(24-26-31)37-35(39)33-27-22-29-20-17-18-21-32(29)34(33)38/h17-18,20-27,36,38H,2-16,19,28H2,1H3,(H,37,39) |
| InChIKey | OGOGFNSEOURORB-UHFFFAOYSA-N |
| Mol Weight | 594.9 g/mol |
| Molecular Formula | C35H50N2O4S |
| Exact Mass | 594.349129 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BWRtKvcOo1k |
|---|---|
| Name | 2-Naphthalenecarboxamide, 1-hydroxy-N-[4-[(octadecylamino)sulfonyl]phenyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 594.349129268 u |
| Formula | C35H50N2O4S |
| InChI | InChI=1S/C35H50N2O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-28-36-42(40,41)31-25-23-30(24-26-31)37-35(39)33-27-22-29-20-17-18-21-32(29)34(33)38/h17-18,20-27,36,38H,2-16,19,28H2,1H3,(H,37,39) |
| InChIKey | OGOGFNSEOURORB-UHFFFAOYSA-N |
| Molecular Weight | 594.855 g/mol |
| SMILES | CCCCCCCCCCCCCCCCCCNS(=O)(=O)C1=CC=C(NC(=O)C2=CC=C3C=CC=CC3=C2O)C=C1 |