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5-[2-[(2,5-Dimethyl-1-pyrrolyl)amino]-2-oxoethoxy]-1-(2-furanylmethyl)-2-methyl-3-indolecarboxylic acid ethyl ester
SpectraBase Compound ID 7N74tofjfWN
InChI InChI=1S/C25H27N3O5/c1-5-31-25(30)24-18(4)27(14-20-7-6-12-32-20)22-11-10-19(13-21(22)24)33-15-23(29)26-28-16(2)8-9-17(28)3/h6-13H,5,14-15H2,1-4H3,(H,26,29)
InChIKey XPVJHLMFEQTJDD-UHFFFAOYSA-N
Mol Weight 449.51 g/mol
Molecular Formula C25H27N3O5
Exact Mass 449.195071 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 96Dv19vFdUc
Name 5-[2-[(2,5-Dimethyl-1-pyrrolyl)amino]-2-oxoethoxy]-1-(2-furanylmethyl)-2-methyl-3-indolecarboxylic acid ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 449.195070976 u
Formula C25H27N3O5
InChI InChI=1S/C25H27N3O5/c1-5-31-25(30)24-18(4)27(14-20-7-6-12-32-20)22-11-10-19(13-21(22)24)33-15-23(29)26-28-16(2)8-9-17(28)3/h6-13H,5,14-15H2,1-4H3,(H,26,29)
InChIKey XPVJHLMFEQTJDD-UHFFFAOYSA-N
Molecular Weight 449.507 g/mol
SMILES C=1(N(C=2C=CC(=CC2C1C(=O)OCC)OCC(=O)NN1C(=CC=C1C)C)CC1=CC=CO1)C