[4-[(5-azanyl-1,2,3,4-tetrazol-1-yl)iminomethyl]-5-bromanyl-2-methoxy-phenyl] ethanoate

Systemtic Name: [4-[(5-azanyl-1,2,3,4-tetrazol-1-yl)iminomethyl]-5-bromanyl-2-methoxy-phenyl] ethanoate Openeye Name: [4-[(5-aminotetrazol-1-yl)iminomethyl]-5-bromo-2-methoxy-phenyl] acetate CAS Name: acetic acid [4-[(5-amino-1-tetrazolyl)iminomethyl]-5-bromo-2-methoxyphenyl] ester IUPAC Name: [4-[(5-aminotetrazol-1-yl)iminomethyl]-5-bromo-2-methoxyphenyl] acetate Traditional Name: acetic acid [4-[(5-aminotetrazol-1-yl)iminomethyl]-5-bromo-2-methoxy-phenyl] ester Formula: C11H11BrN6O3 MolecularWeight: 355.14744

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C(=C1)Br)C=NN2C(=NN=N2)N)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C(=C1)Br)C=NN2C(=NN=N2)N)OC

InChI

InChI=1S/C11H11BrN6O3/c1-6(19)21-10-4-8(12)7(3-9(10)20-2)5-14-18-11(13)15-16-17-18/h3-5H,1-2H3,(H2,13,15,17)