For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

ethyl 2-{[[(2E)-2-(2,4-dichlorobenzylidene)hydrazino](oxo)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

View entire compound with spectra: 2 NMR

ethyl 2-{[[(2E)-2-(2,4-dichlorobenzylidene)hydrazino](oxo)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
SpectraBase Compound ID NHaLb86m43
InChI InChI=1S/C21H21Cl2N3O4S/c1-2-30-21(29)17-14-6-4-3-5-7-16(14)31-20(17)25-18(27)19(28)26-24-11-12-8-9-13(22)10-15(12)23/h8-11H,2-7H2,1H3,(H,25,27)(H,26,28)/b24-11+
InChIKey MZXHSTOKCWPMPX-BHGWPJFGSA-N
Mol Weight 482.38 g/mol
Molecular Formula C21H21Cl2N3O4S
Exact Mass 481.062983 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID A8ckL03BUYA
Name Ethyl 2-{[[(2E)-2-(2,4-dichlorobenzylidene)hydrazino](oxo)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[B]thiophene-3-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 481.062982738 u
Formula C21H21Cl2N3O4S
InChI InChI=1S/C21H21Cl2N3O4S/c1-2-30-21(29)17-14-6-4-3-5-7-16(14)31-20(17)25-18(27)19(28)26-24-11-12-8-9-13(22)10-15(12)23/h8-11H,2-7H2,1H3,(H,25,27)(H,26,28)/b24-11+
InChIKey MZXHSTOKCWPMPX-BHGWPJFGSA-N
Molecular Weight 482.382 g/mol
SMILES N(C1=C(C=2CCCCCC2S1)C(=O)OCC)C(C(N\N=C\C=1C(=CC(=CC1)Cl)Cl)=O)=O