6-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-3-ethoxycarbonyl-1,2,4-triazin-5-olate

Systemtic Name: 6-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-3-ethoxycarbonyl-1,2,4-triazin-5-olate Openeye Name: 6-[2-(4-chlorophenyl)-2-oxo-ethyl]-3-ethoxycarbonyl-1,2,4-triazin-5-olate CAS Name: 6-[2-(4-chlorophenyl)-2-oxoethyl]-3-ethoxycarbonyl-1,2,4-triazin-5-olate IUPAC Name: 6-[2-(4-chlorophenyl)-2-oxoethyl]-3-ethoxycarbonyl-1,2,4-triazin-5-olate Traditional Name: 3-carbethoxy-6-[2-(4-chlorophenyl)-2-keto-ethyl]-1,2,4-triazin-5-olate Formula: C14H11ClN3O4- MolecularWeight: 320.70784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=C(N=N1)CC(=O)C2=CC=C(C=C2)Cl)[O-]

Isomeric SMILES

CCOC(=O)C1=NC(=C(N=N1)CC(=O)C2=CC=C(C=C2)Cl)[O-]

InChI

InChI=1S/C14H12ClN3O4/c1-2-22-14(21)12-16-13(20)10(17-18-12)7-11(19)8-3-5-9(15)6-4-8/h3-6H,2,7H2,1H3,(H,16,18,20)/p-1