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3-Amino-4-chlorobenzamide -> 2-hydroxynaphthoic arylide-4-aminoacetylanilide

View entire compound with spectra: 1 NMR, and 2 FTIR

3-Amino-4-chlorobenzamide -> 2-hydroxynaphthoic arylide-4-aminoacetylanilide
SpectraBase Compound ID 8eWbLN7Idab
InChI InChI=1S/C26H20ClN5O4/c1-14(33)29-17-7-9-18(10-8-17)30-26(36)20-12-15-4-2-3-5-19(15)23(24(20)34)32-31-22-13-16(25(28)35)6-11-21(22)27/h2-13,34H,1H3,(H2,28,35)(H,29,33)(H,30,36)/b32-31+
InChIKey UHZVOVCIPHZPEI-QNEJGDQOSA-N
Mol Weight 501.93 g/mol
Molecular Formula C26H20ClN5O4
Exact Mass 501.120382 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BxpnaCFXzBp
Name 3-Amino-4-chlorobenzamide -> 2-hydroxynaphthoic arylide-4-aminoacetylanilide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 501.120381840 u
Formula C26H20ClN5O4
InChI InChI=1S/C26H20ClN5O4/c1-14(33)29-17-7-9-18(10-8-17)30-26(36)20-12-15-4-2-3-5-19(15)23(24(20)34)32-31-22-13-16(25(28)35)6-11-21(22)27/h2-13,34H,1H3,(H2,28,35)(H,29,33)(H,30,36)/b32-31+
InChIKey UHZVOVCIPHZPEI-QNEJGDQOSA-N
Molecular Weight 501.930 g/mol
SMILES N(C1=CC=C(C=C1)NC(C1=C(C(=C2C(=C1)C=CC=C2)\N=N\C1=CC(=CC=C1Cl)C(N)=O)O)=O)C(C)=O