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

Systemtic Name: cyanomethyl 4-[5-[(5-azanyl-1,2,3,4-tetrazol-1-yl)iminomethyl]furan-2-yl]benzoate Openeye Name: cyanomethyl 4-[5-[(5-aminotetrazol-1-yl)iminomethyl]-2-furyl]benzoate CAS Name: 4-[5-[(5-amino-1-tetrazolyl)iminomethyl]-2-furanyl]benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 4-[5-[(5-aminotetrazol-1-yl)iminomethyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(5-aminotetrazol-1-yl)iminomethyl]-2-furyl]benzoic acid cyanomethyl ester Formula: C15H11N7O3 MolecularWeight: 337.29294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(O2)C=NN3C(=NN=N3)N)C(=O)OCC#N

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(O2)C=NN3C(=NN=N3)N)C(=O)OCC#N

InChI

InChI=1S/C15H11N7O3/c16-7-8-24-14(23)11-3-1-10(2-4-11)13-6-5-12(25-13)9-18-22-15(17)19-20-21-22/h1-6,9H,8H2,(H2,17,19,21)