[4-[bis(azanyl)methylidenecarbamoyl]-5-methoxy-2-(trifluoromethyl)phenyl] ethanoate

Systemtic Name: [4-[bis(azanyl)methylidenecarbamoyl]-5-methoxy-2-(trifluoromethyl)phenyl] ethanoate Openeye Name: [4-(diaminomethylenecarbamoyl)-5-methoxy-2-(trifluoromethyl)phenyl] acetate CAS Name: acetic acid [4-[(diaminomethylideneamino)-oxomethyl]-5-methoxy-2-(trifluoromethyl)phenyl] ester IUPAC Name: [4-(diaminomethylidenecarbamoyl)-5-methoxy-2-(trifluoromethyl)phenyl] acetate Traditional Name: acetic acid [4-(diaminomethylenecarbamoyl)-5-methoxy-2-(trifluoromethyl)phenyl] ester Formula: C12H12F3N3O4 MolecularWeight: 319.23659

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C(=C1)OC)C(=O)N=C(N)N)C(F)(F)F

Isomeric SMILES

CC(=O)OC1=C(C=C(C(=C1)OC)C(=O)N=C(N)N)C(F)(F)F

InChI

InChI=1S/C12H12F3N3O4/c1-5(19)22-9-4-8(21-2)6(10(20)18-11(16)17)3-7(9)12(13,14)15/h3-4H,1-2H3,(H4,16,17,18,20)