5-chloranyl-2-ethoxy-4-(4-methoxy-3-methyl-5-oxidanylidene-1,2,4-triazol-1-yl)benzenecarbonitrile

Systemtic Name: 5-chloranyl-2-ethoxy-4-(4-methoxy-3-methyl-5-oxidanylidene-1,2,4-triazol-1-yl)benzenecarbonitrile Openeye Name: 5-chloro-2-ethoxy-4-(4-methoxy-3-methyl-5-oxo-1,2,4-triazol-1-yl)benzonitrile CAS Name: 5-chloro-2-ethoxy-4-(4-methoxy-3-methyl-5-oxo-1,2,4-triazol-1-yl)benzonitrile IUPAC Name: 5-chloro-2-ethoxy-4-(4-methoxy-3-methyl-5-oxo-1,2,4-triazol-1-yl)benzonitrile Traditional Name: 5-chloro-2-ethoxy-4-(5-keto-4-methoxy-3-methyl-1,2,4-triazol-1-yl)benzonitrile Formula: C13H13ClN4O3 MolecularWeight: 308.72032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1C#N)Cl)N2C(=O)N(C(=N2)C)OC

Isomeric SMILES

CCOC1=CC(=C(C=C1C#N)Cl)N2C(=O)N(C(=N2)C)OC

InChI

InChI=1S/C13H13ClN4O3/c1-4-21-12-6-11(10(14)5-9(12)7-15)17-13(19)18(20-3)8(2)16-17/h5-6H,4H2,1-3H3