4-[2-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinyl]-3-oxidanidyl-naphthalene-1-sulfonate

Systemtic Name: 4-[2-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinyl]-3-oxidanidyl-naphthalene-1-sulfonate Openeye Name: 4-[2-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)hydrazino]-3-oxido-naphthalene-1-sulfonate CAS Name: 4-[2-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)hydrazinyl]-3-oxido-1-naphthalenesulfonate IUPAC Name: 4-[2-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)hydrazinyl]-3-oxidonaphthalene-1-sulfonate Traditional Name: 4-[N'-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)hydrazino]-3-oxido-naphthalene-1-sulfonate Formula: C20H14N4O5S-2 MolecularWeight: 422.41396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)[O-])[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)C1=NNC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)[O-])[O-])C4=CC=CC=C4

InChI

InChI=1S/C20H16N4O5S/c1-12-18(20(26)24(23-12)13-7-3-2-4-8-13)21-22-19-15-10-6-5-9-14(15)17(11-16(19)25)30(27,28)29/h2-11,22,25H,1H3,(H,27,28,29)/p-2