ethyl 2-[4-(4-chlorophenyl)-5-oxidanylidene-1,2,3,4-tetrazol-1-yl]propanoate

Systemtic Name: ethyl 2-[4-(4-chlorophenyl)-5-oxidanylidene-1,2,3,4-tetrazol-1-yl]propanoate Openeye Name: ethyl 2-[4-(4-chlorophenyl)-5-oxo-tetrazol-1-yl]propanoate CAS Name: 2-[4-(4-chlorophenyl)-5-oxo-1-tetrazolyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-chlorophenyl)-5-oxotetrazol-1-yl]propanoate Traditional Name: 2-[4-(4-chlorophenyl)-5-keto-tetrazol-1-yl]propionic acid ethyl ester Formula: C12H13ClN4O3 MolecularWeight: 296.70962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)N1C(=O)N(N=N1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C(C)N1C(=O)N(N=N1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H13ClN4O3/c1-3-20-11(18)8(2)16-12(19)17(15-14-16)10-6-4-9(13)5-7-10/h4-8H,3H2,1-2H3