[2-methoxy-4-(2-oxidanylidene-2-pyridin-4-yl-ethanehydrazonoyl)phenyl] 4-nitrobenzoate

Systemtic Name: [2-methoxy-4-(2-oxidanylidene-2-pyridin-4-yl-ethanehydrazonoyl)phenyl] 4-nitrobenzoate Openeye Name: [2-methoxy-4-[2-oxo-2-(4-pyridyl)ethanehydrazonoyl]phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-[(1E)-1-hydrazinylidene-2-oxo-2-pyridin-4-ylethyl]-2-methoxyphenyl] ester IUPAC Name: [2-methoxy-4-(2-oxo-2-pyridin-4-ylethanehydrazonoyl)phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-[2-keto-2-(4-pyridyl)acetohydrazonoyl]-2-methoxy-phenyl] ester Formula: C21H16N4O6 MolecularWeight: 420.37494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=NN)C(=O)C2=CC=NC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C(=N\N)/C(=O)C2=CC=NC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O6/c1-30-18-12-15(19(24-22)20(26)13-8-10-23-11-9-13)4-7-17(18)31-21(27)14-2-5-16(6-3-14)25(28)29/h2-12H,22H2,1H3/b24-19+