1-methylidene-8-[methyl-[(E)-(1-methylpyridin-2-ylidene)amino]amino]-5-oxidanylidene-quinolin-1-ium-3-sulfonic acid

Systemtic Name: 1-methylidene-8-[methyl-[(E)-(1-methylpyridin-2-ylidene)amino]amino]-5-oxidanylidene-quinolin-1-ium-3-sulfonic acid Openeye Name: 1-methylene-8-[methyl-[(E)-(1-methyl-2-pyridylidene)amino]amino]-5-oxo-quinolin-1-ium-3-sulfonic acid CAS Name: 1-methylene-8-[methyl-[(E)-(1-methyl-2-pyridinylidene)amino]amino]-5-oxo-3-quinolin-1-iumsulfonic acid IUPAC Name: 1-methylidene-8-[methyl-[(E)-(1-methylpyridin-2-ylidene)amino]amino]-5-oxoquinolin-1-ium-3-sulfonic acid Traditional Name: 5-keto-1-methylene-8-[methyl-[(E)-(1-methyl-2-pyridylidene)amino]amino]quinolin-1-ium-3-sulfonic acid Formula: C17H17N4O4S+ MolecularWeight: 373.40628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=CC1=NN(C)C2=C3C(=CC(=C[N+]3=C)S(=O)(=O)O)C(=O)C=C2

Isomeric SMILES

CN\1C=CC=C/C1=N\N(C)C2=C3C(=CC(=C[N+]3=C)S(=O)(=O)O)C(=O)C=C2

InChI

InChI=1S/C17H16N4O4S/c1-19-9-5-4-6-16(19)18-21(3)14-7-8-15(22)13-10-12(26(23,24)25)11-20(2)17(13)14/h4-11H,2H2,1,3H3/p+1/b18-16+