N-(4-dimethylaminophenyl)-1-ethoxycarbonyl-3-methyl-5-oxidanylidene-pyrazol-4-imine oxide

Systemtic Name: N-(4-dimethylaminophenyl)-1-ethoxycarbonyl-3-methyl-5-oxidanylidene-pyrazol-4-imine oxide Openeye Name: N-(4-dimethylaminophenyl)-1-ethoxycarbonyl-3-methyl-5-oxo-pyrazol-4-imine oxide CAS Name: N-(4-dimethylaminophenyl)-1-ethoxycarbonyl-3-methyl-5-oxo-4-pyrazolimine oxide IUPAC Name: N-(4-dimethylaminophenyl)-1-ethoxycarbonyl-3-methyl-5-oxopyrazol-4-imine oxide Traditional Name: 1-carbethoxy-N-(4-dimethylaminophenyl)-5-keto-3-methyl-2-pyrazolin-4-imine oxide Formula: C15H18N4O4 MolecularWeight: 318.32782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(=O)C(=[N+](C2=CC=C(C=C2)N(C)C)[O-])C(=N1)C

Isomeric SMILES

CCOC(=O)N1C(=O)/C(=[N+](\C2=CC=C(C=C2)N(C)C)/[O-])/C(=N1)C

InChI

InChI=1S/C15H18N4O4/c1-5-23-15(21)18-14(20)13(10(2)16-18)19(22)12-8-6-11(7-9-12)17(3)4/h6-9H,5H2,1-4H3/b19-13+