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dimethyl 2-azido-5-[5-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-2-yl]hexanedioate

dimethyl 2-azido-5-[5-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-2-yl]hexanedioate

Systemtic Name:dimethyl 2-azido-5-[5-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-2-yl]hexanedioate
Openeye Name:dimethyl 2-azido-5-[5-(2-thienylmethyl)tetrazol-2-yl]hexanedioate
CAS Name:2-azido-5-[5-(thiophen-2-ylmethyl)-2-tetrazolyl]hexanedioic acid dimethyl ester
IUPAC Name:dimethyl 2-azido-5-[5-(thiophen-2-ylmethyl)tetrazol-2-yl]hexanedioate
Traditional Name:2-azido-5-[5-(2-thenyl)tetrazol-2-yl]adipic acid dimethyl ester
Formula: C14H17N7O4S
MolecularWeight: 379.39428
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC(C(=O)OC)N1N=C(N=N1)CC2=CC=CS2)N=[N+]=[N-]


Isomeric SMILES

COC(=O)C(CCC(C(=O)OC)N1N=C(N=N1)CC2=CC=CS2)N=[N+]=[N-]


InChI

InChI=1S/C14H17N7O4S/c1-24-13(22)10(16-19-15)5-6-11(14(23)25-2)21-18-12(17-20-21)8-9-4-3-7-26-9/h3-4,7,10-11H,5-6,8H2,1-2H3


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