7-(5-methyl-3-oxidanylidene-1H-pyrazol-2-yl)naphthalene-1,3-disulfonic acid

Systemtic Name: 7-(5-methyl-3-oxidanylidene-1H-pyrazol-2-yl)naphthalene-1,3-disulfonic acid Openeye Name: 7-(5-methyl-3-oxo-1H-pyrazol-2-yl)naphthalene-1,3-disulfonic acid CAS Name: 7-(5-methyl-3-oxo-1H-pyrazol-2-yl)naphthalene-1,3-disulfonic acid IUPAC Name: 7-(5-methyl-3-oxo-1H-pyrazol-2-yl)naphthalene-1,3-disulfonic acid Traditional Name: 7-(5-keto-3-methyl-3-pyrazolin-1-yl)naphthalene-1,3-disulfonic acid Formula: C14H12N2O7S2 MolecularWeight: 384.38428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1)C2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=O)N(N1)C2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C14H12N2O7S2/c1-8-4-14(17)16(15-8)10-3-2-9-5-11(24(18,19)20)7-13(12(9)6-10)25(21,22)23/h2-7,15H,1H3,(H,18,19,20)(H,21,22,23)