4-methylpyridine; 2-oxidanylidene-1-phenyl-indole-3,3-diolate

Systemtic Name: 4-methylpyridine; 2-oxidanylidene-1-phenyl-indole-3,3-diolate Openeye Name: 4-methylpyridine; 2-oxo-1-phenyl-indoline-3,3-diolate CAS Name: 4-methylpyridine; 2-oxo-1-phenylindole-3,3-diolate IUPAC Name: 4-methylpyridine; 2-oxo-1-phenylindole-3,3-diolate Traditional Name: $g-picoline; 2-keto-1-phenyl-indoline-3,3-diolate Formula: C20H16N2O3-2 MolecularWeight: 332.35264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NC=C1.C1=CC=C(C=C1)N2C3=CC=CC=C3C(C2=O)([O-])[O-]

Isomeric SMILES

CC1=CC=NC=C1.C1=CC=C(C=C1)N2C3=CC=CC=C3C(C2=O)([O-])[O-]

InChI

InChI=1S/C14H9NO3.C6H7N/c16-13-14(17,18)11-8-4-5-9-12(11)15(13)10-6-2-1-3-7-10;1-6-2-4-7-5-3-6/h1-9H;2-5H,1H3/q-2;