propan-2-yl 4-[5-[(E)-1,2,4-triazol-4-yliminomethyl]furan-2-yl]benzoate

Systemtic Name: propan-2-yl 4-[5-[(E)-1,2,4-triazol-4-yliminomethyl]furan-2-yl]benzoate Openeye Name: isopropyl 4-[5-[(E)-1,2,4-triazol-4-yliminomethyl]-2-furyl]benzoate CAS Name: 4-[5-[(E)-1,2,4-triazol-4-yliminomethyl]-2-furanyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[5-[(E)-1,2,4-triazol-4-yliminomethyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(E)-1,2,4-triazol-4-yliminomethyl]-2-furyl]benzoic acid isopropyl ester Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=NN3C=NN=C3

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=N/N3C=NN=C3

InChI

InChI=1S/C17H16N4O3/c1-12(2)23-17(22)14-5-3-13(4-6-14)16-8-7-15(24-16)9-20-21-10-18-19-11-21/h3-12H,1-2H3/b20-9+