ethyl 2-[5-(3-chloranyl-4-methyl-phenyl)-1,2,3,4-tetrazol-2-yl]ethanoate

Systemtic Name: ethyl 2-[5-(3-chloranyl-4-methyl-phenyl)-1,2,3,4-tetrazol-2-yl]ethanoate Openeye Name: ethyl 2-[5-(3-chloro-4-methyl-phenyl)tetrazol-2-yl]acetate CAS Name: 2-[5-(3-chloro-4-methylphenyl)-2-tetrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(3-chloro-4-methylphenyl)tetrazol-2-yl]acetate Traditional Name: 2-[5-(3-chloro-4-methyl-phenyl)tetrazol-2-yl]acetic acid ethyl ester Formula: C12H13ClN4O2 MolecularWeight: 280.71022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1N=C(N=N1)C2=CC(=C(C=C2)C)Cl

Isomeric SMILES

CCOC(=O)CN1N=C(N=N1)C2=CC(=C(C=C2)C)Cl

InChI

InChI=1S/C12H13ClN4O2/c1-3-19-11(18)7-17-15-12(14-16-17)9-5-4-8(2)10(13)6-9/h4-6H,3,7H2,1-2H3