4-[[(Z)-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-ylidene)methyl]amino]benzenesulfonic acid

Systemtic Name: 4-[[(Z)-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-ylidene)methyl]amino]benzenesulfonic acid Openeye Name: 4-[[(Z)-(3-methylene-5-oxo-1-phenyl-pyrazolidin-4-ylidene)methyl]amino]benzenesulfonic acid CAS Name: 4-[[(Z)-(3-methylene-5-oxo-1-phenyl-4-pyrazolidinylidene)methyl]amino]benzenesulfonic acid IUPAC Name: 4-[[(Z)-(3-methylidene-5-oxo-1-phenylpyrazolidin-4-ylidene)methyl]amino]benzenesulfonic acid Traditional Name: 4-[[(Z)-(5-keto-3-methylene-1-phenyl-pyrazolidin-4-ylidene)methyl]amino]besylic acid Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(=CNC2=CC=C(C=C2)S(=O)(=O)O)C(=O)N(N1)C3=CC=CC=C3

Isomeric SMILES

C=C1/C(=C/NC2=CC=C(C=C2)S(=O)(=O)O)/C(=O)N(N1)C3=CC=CC=C3

InChI

InChI=1S/C17H15N3O4S/c1-12-16(17(21)20(19-12)14-5-3-2-4-6-14)11-18-13-7-9-15(10-8-13)25(22,23)24/h2-11,18-19H,1H2,(H,22,23,24)/b16-11-