methyl (2Z)-2-cyano-2-[1-(4-ethylphenyl)-2H-1,2,3,4-tetrazol-5-ylidene]ethanoate

Systemtic Name: methyl (2Z)-2-cyano-2-[1-(4-ethylphenyl)-2H-1,2,3,4-tetrazol-5-ylidene]ethanoate Openeye Name: methyl (2Z)-2-cyano-2-[1-(4-ethylphenyl)-2H-tetrazol-5-ylidene]acetate CAS Name: (2Z)-2-cyano-2-[1-(4-ethylphenyl)-2H-tetrazol-5-ylidene]acetic acid methyl ester IUPAC Name: methyl (2Z)-2-cyano-2-[1-(4-ethylphenyl)-2H-tetrazol-5-ylidene]acetate Traditional Name: (2Z)-2-cyano-2-[1-(4-ethylphenyl)-2H-tetrazol-5-ylidene]acetic acid methyl ester Formula: C13H13N5O2 MolecularWeight: 271.27462

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=C(C#N)C(=O)OC)N=NN2

Isomeric SMILES

CCC1=CC=C(C=C1)N2/C(=C(\C#N)/C(=O)OC)/N=NN2

InChI

InChI=1S/C13H13N5O2/c1-3-9-4-6-10(7-5-9)18-12(15-16-17-18)11(8-14)13(19)20-2/h4-7H,3H2,1-2H3,(H,15,17)/b12-11+