methyl 2-chloranyl-5-[5-[(Z)-1,2,4-triazol-4-yliminomethyl]furan-2-yl]benzoate

Systemtic Name: methyl 2-chloranyl-5-[5-[(Z)-1,2,4-triazol-4-yliminomethyl]furan-2-yl]benzoate Openeye Name: methyl 2-chloro-5-[5-[(Z)-1,2,4-triazol-4-yliminomethyl]-2-furyl]benzoate CAS Name: 2-chloro-5-[5-[(Z)-1,2,4-triazol-4-yliminomethyl]-2-furanyl]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[5-[(Z)-1,2,4-triazol-4-yliminomethyl]furan-2-yl]benzoate Traditional Name: 2-chloro-5-[5-[(Z)-1,2,4-triazol-4-yliminomethyl]-2-furyl]benzoic acid methyl ester Formula: C15H11ClN4O3 MolecularWeight: 330.72584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)/C=N\N3C=NN=C3)Cl

InChI

InChI=1S/C15H11ClN4O3/c1-22-15(21)12-6-10(2-4-13(12)16)14-5-3-11(23-14)7-19-20-8-17-18-9-20/h2-9H,1H3/b19-7-