7-[2-(2-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]naphthalene-1,3-disulfonic acid; sodium

Systemtic Name: 7-[2-(2-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]naphthalene-1,3-disulfonic acid; sodium Openeye Name: 7-[2-(2-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)hydrazino]naphthalene-1,3-disulfonic acid; sodium CAS Name: 7-[2-(2-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]naphthalene-1,3-disulfonic acid; sodium IUPAC Name: 7-[2-(2-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]naphthalene-1,3-disulfonic acid; sodium Traditional Name: 7-[N'-(4-keto-2-methyl-cyclohexa-2,5-dien-1-ylidene)hydrazino]naphthalene-1,3-disulfonic acid; sodium Formula: C17H14N2NaO7S2 MolecularWeight: 445.42203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C=CC1=NNC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)S(=O)(=O)O.[Na]

Isomeric SMILES

CC1=CC(=O)C=CC1=NNC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)S(=O)(=O)O.[Na]

InChI

InChI=1S/C17H14N2O7S2.Na/c1-10-6-13(20)4-5-16(10)19-18-12-3-2-11-7-14(27(21,22)23)9-17(15(11)8-12)28(24,25)26;/h2-9,18H,1H3,(H,21,22,23)(H,24,25,26);