methyl 4-[(E)-(5-azanyl-1,2,3,4-tetrazol-1-yl)iminomethyl]benzoate

Systemtic Name: methyl 4-[(E)-(5-azanyl-1,2,3,4-tetrazol-1-yl)iminomethyl]benzoate Openeye Name: methyl 4-[(E)-(5-aminotetrazol-1-yl)iminomethyl]benzoate CAS Name: 4-[(E)-(5-amino-1-tetrazolyl)iminomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-(5-aminotetrazol-1-yl)iminomethyl]benzoate Traditional Name: 4-[(E)-(5-aminotetrazol-1-yl)iminomethyl]benzoic acid methyl ester Formula: C10H10N6O2 MolecularWeight: 246.2254

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=NN2C(=NN=N2)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=N/N2C(=NN=N2)N

InChI

InChI=1S/C10H10N6O2/c1-18-9(17)8-4-2-7(3-5-8)6-12-16-10(11)13-14-15-16/h2-6H,1H3,(H2,11,13,15)/b12-6+