ethyl 4-[(2Z)-2-[3-(4-methoxyphenyl)-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene]hydrazinyl]benzoate; methane

Systemtic Name: ethyl 4-[(2Z)-2-[3-(4-methoxyphenyl)-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene]hydrazinyl]benzoate; methane Openeye Name: ethyl 4-[(2Z)-2-[3-(4-methoxyphenyl)-5-oxo-1-phenyl-pyrazol-4-ylidene]hydrazino]benzoate; methane CAS Name: methane; 4-[(2Z)-2-[3-(4-methoxyphenyl)-5-oxo-1-phenyl-4-pyrazolylidene]hydrazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2Z)-2-[3-(4-methoxyphenyl)-5-oxo-1-phenylpyrazol-4-ylidene]hydrazinyl]benzoate; methane Traditional Name: 4-[(N'Z)-N'-[5-keto-3-(4-methoxyphenyl)-1-phenyl-2-pyrazolin-4-ylidene]hydrazino]benzoic acid ethyl ester; methane Formula: C26H26N4O4 MolecularWeight: 458.50904

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Descriptors Computed from Structure

Canonical SMILES:

C.CCOC(=O)C1=CC=C(C=C1)NN=C2C(=NN(C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

C.CCOC(=O)C1=CC=C(C=C1)N/N=C\2/C(=NN(C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H22N4O4.CH4/c1-3-33-25(31)18-9-13-19(14-10-18)26-27-23-22(17-11-15-21(32-2)16-12-17)28-29(24(23)30)20-7-5-4-6-8-20;/h4-16,26H,3H2,1-2H3;1H4/b27-23-;