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N-[3-((1E)-N-{5-[(3,5-dimethylphenoxy)methyl]-2-furoyl}ethanehydrazonoyl)phenyl]cyclobutanecarboxamide

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N-[3-((1E)-N-{5-[(3,5-dimethylphenoxy)methyl]-2-furoyl}ethanehydrazonoyl)phenyl]cyclobutanecarboxamide
SpectraBase Compound ID CiKHYEXC4RD
InChI InChI=1S/C27H29N3O4/c1-17-12-18(2)14-24(13-17)33-16-23-10-11-25(34-23)27(32)30-29-19(3)21-8-5-9-22(15-21)28-26(31)20-6-4-7-20/h5,8-15,20H,4,6-7,16H2,1-3H3,(H,28,31)(H,30,32)/b29-19+
InChIKey LLDRHZVBYYMEFT-VUTHCHCSSA-N
Mol Weight 459.55 g/mol
Molecular Formula C27H29N3O4
Exact Mass 459.215806 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BiLcA4lMyJO
Name N-[3-((1E)-N-{5-[(3,5-Dimethylphenoxy)methyl]-2-furoyl}ethanehydrazonoyl)phenyl]cyclobutanecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 459.215806422 u
Formula C27H29N3O4
InChI InChI=1S/C27H29N3O4/c1-17-12-18(2)14-24(13-17)33-16-23-10-11-25(34-23)27(32)30-29-19(3)21-8-5-9-22(15-21)28-26(31)20-6-4-7-20/h5,8-15,20H,4,6-7,16H2,1-3H3,(H,28,31)(H,30,32)/b29-19+
InChIKey LLDRHZVBYYMEFT-VUTHCHCSSA-N
Molecular Weight 459.546 g/mol
SMILES N(C(C=1OC(COC2=CC(=CC(=C2)C)C)=CC1)=O)\N=C\(C=1C=C(NC(=O)C2CCC2)C=CC1)C