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(R)-N-(2-Chlorobenzyl)-1-((2-methylbenzoyl)-D-prolyl)pyrrolidine-2-carboxamide

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(R)-N-(2-Chlorobenzyl)-1-((2-methylbenzoyl)-D-prolyl)pyrrolidine-2-carboxamide
SpectraBase Compound ID IlcSr6rFaSR
InChI InChI=1S/C25H28ClN3O3/c1-17-8-2-4-10-19(17)24(31)29-15-7-13-22(29)25(32)28-14-6-12-21(28)23(30)27-16-18-9-3-5-11-20(18)26/h2-5,8-11,21-22H,6-7,12-16H2,1H3,(H,27,30)/t21-,22-/m1/s1
InChIKey YCLVGNGXROYFHV-FGZHOGPDSA-N
Mol Weight 453.97 g/mol
Molecular Formula C25H28ClN3O3
Exact Mass 453.181919 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CLZhnMK7tPq
Name (R)-N-(2-Chlorobenzyl)-1-((2-methylbenzoyl)-D-prolyl)pyrrolidine-2-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 453.181919471 u
Formula C25H28ClN3O3
InChI InChI=1S/C25H28ClN3O3/c1-17-8-2-4-10-19(17)24(31)29-15-7-13-22(29)25(32)28-14-6-12-21(28)23(30)27-16-18-9-3-5-11-20(18)26/h2-5,8-11,21-22H,6-7,12-16H2,1H3,(H,27,30)/t21-,22-/m1/s1
InChIKey YCLVGNGXROYFHV-FGZHOGPDSA-N
Molecular Weight 453.970 g/mol
SMILES [C@@]1(N(CCC1)C([C@@]1(N(CCC1)C(C1=C(C=CC=C1)C)=O)[H])=O)(C(=O)NCC1=C(C=CC=C1)Cl)[H]