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(S)-4-Chloro-N-(3-oxo-3-((1,2,3,4-tetrahydronaphthalen-1-yl)amino)propyl)benzamide

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(S)-4-Chloro-N-(3-oxo-3-((1,2,3,4-tetrahydronaphthalen-1-yl)amino)propyl)benzamide
SpectraBase Compound ID 74AKLx4aHLT
InChI InChI=1S/C20H21ClN2O2/c21-16-10-8-15(9-11-16)20(25)22-13-12-19(24)23-18-7-3-5-14-4-1-2-6-17(14)18/h1-2,4,6,8-11,18H,3,5,7,12-13H2,(H,22,25)(H,23,24)/t18-/m0/s1
InChIKey WDLPDTHFFBNPGK-SFHVURJKSA-N
Mol Weight 356.85 g/mol
Molecular Formula C20H21ClN2O2
Exact Mass 356.129156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FE5VEIuPL2T
Name (S)-4-Chloro-N-(3-oxo-3-((1,2,3,4-tetrahydronaphthalen-1-yl)amino)propyl)benzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.129155622 u
Formula C20H21ClN2O2
InChI InChI=1S/C20H21ClN2O2/c21-16-10-8-15(9-11-16)20(25)22-13-12-19(24)23-18-7-3-5-14-4-1-2-6-17(14)18/h1-2,4,6,8-11,18H,3,5,7,12-13H2,(H,22,25)(H,23,24)/t18-/m0/s1
InChIKey WDLPDTHFFBNPGK-SFHVURJKSA-N
Molecular Weight 356.853 g/mol
SMILES C(C1=CC=C(C=C1)Cl)(=O)NCCC(N[C@]1(CCCC2=C1C=CC=C2)[H])=O