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ethyl 2-{[4-(ethoxycarbonyl)-4-phenyl-1-piperidinyl]methyl}-5-hydroxy-1-phenyl-1H-indole-3-carboxylate
SpectraBase Compound ID 19j3fRuMz0
InChI InChI=1S/C32H34N2O5/c1-3-38-30(36)29-26-21-25(35)15-16-27(26)34(24-13-9-6-10-14-24)28(29)22-33-19-17-32(18-20-33,31(37)39-4-2)23-11-7-5-8-12-23/h5-16,21,35H,3-4,17-20,22H2,1-2H3
InChIKey CHKBMOSFDBMDKF-UHFFFAOYSA-N
Mol Weight 526.6 g/mol
Molecular Formula C32H34N2O5
Exact Mass 526.246772 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Jbx6XRM0Fn
Name Ethyl 2-{[4-(ethoxycarbonyl)-4-phenyl-1-piperidinyl]methyl}-5-hydroxy-1-phenyl-1H-indole-3-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 526.246772198 u
Formula C32H34N2O5
InChI InChI=1S/C32H34N2O5/c1-3-38-30(36)29-26-21-25(35)15-16-27(26)34(24-13-9-6-10-14-24)28(29)22-33-19-17-32(18-20-33,31(37)39-4-2)23-11-7-5-8-12-23/h5-16,21,35H,3-4,17-20,22H2,1-2H3
InChIKey CHKBMOSFDBMDKF-UHFFFAOYSA-N
Molecular Weight 526.633 g/mol
SMILES OC=1C=C2C(=C(N(C=3C=CC=CC3)C2=CC1)CN1CCC(CC1)(C(=O)OCC)C=1C=CC=CC1)C(=O)OCC