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2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-N-(2-phenoxyethyl)acetamide
SpectraBase Compound ID C7LZFrZa4o6
InChI InChI=1S/C27H25ClN2O4/c1-18-23(17-26(31)29-14-15-34-21-6-4-3-5-7-21)24-16-22(33-2)12-13-25(24)30(18)27(32)19-8-10-20(28)11-9-19/h3-13,16H,14-15,17H2,1-2H3,(H,29,31)
InChIKey PJKOQQCLYFPOOU-UHFFFAOYSA-N
Mol Weight 476.96 g/mol
Molecular Formula C27H25ClN2O4
Exact Mass 476.150285 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AWO0qiSEu8w
Name 2-[1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-N-(2-phenoxyethyl)acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 476.150284989 u
Formula C27H25ClN2O4
InChI InChI=1S/C27H25ClN2O4/c1-18-23(17-26(31)29-14-15-34-21-6-4-3-5-7-21)24-16-22(33-2)12-13-25(24)30(18)27(32)19-8-10-20(28)11-9-19/h3-13,16H,14-15,17H2,1-2H3,(H,29,31)
InChIKey PJKOQQCLYFPOOU-UHFFFAOYSA-N
Molecular Weight 476.960 g/mol
SMILES C=1C=CC(OCCNC(CC2=C(N(C3=C2C=C(C=C3)OC)C(C=2C=CC(=CC2)Cl)=O)C)=O)=CC1