(3-bromanyl-4-methoxy-phenyl)methyl 2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanoate

Systemtic Name: (3-bromanyl-4-methoxy-phenyl)methyl 2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: (3-bromo-4-methoxy-phenyl)methyl 2-[5-(3-thienyl)tetrazol-2-yl]acetate CAS Name: 2-[5-(3-thiophenyl)-2-tetrazolyl]acetic acid (3-bromo-4-methoxyphenyl)methyl ester IUPAC Name: (3-bromo-4-methoxyphenyl)methyl 2-(5-thiophen-3-yltetrazol-2-yl)acetate Traditional Name: 2-[5-(3-thienyl)tetrazol-2-yl]acetic acid (3-bromo-4-methoxy-benzyl) ester Formula: C15H13BrN4O3S MolecularWeight: 409.25772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)CN2N=C(N=N2)C3=CSC=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)CN2N=C(N=N2)C3=CSC=C3)Br

InChI

InChI=1S/C15H13BrN4O3S/c1-22-13-3-2-10(6-12(13)16)8-23-14(21)7-20-18-15(17-19-20)11-4-5-24-9-11/h2-6,9H,7-8H2,1H3