4-methylpyridine; 2-oxidanylidene-1-phenyl-3-(pyridin-4-ylmethyl)indol-3-olate

Systemtic Name: 4-methylpyridine; 2-oxidanylidene-1-phenyl-3-(pyridin-4-ylmethyl)indol-3-olate Openeye Name: 4-methylpyridine; 2-oxo-1-phenyl-3-(4-pyridylmethyl)indolin-3-olate CAS Name: 4-methylpyridine; 2-oxo-1-phenyl-3-(pyridin-4-ylmethyl)-3-indololate IUPAC Name: 4-methylpyridine; 2-oxo-1-phenyl-3-(pyridin-4-ylmethyl)indol-3-olate Traditional Name: $g-picoline; 2-keto-1-phenyl-3-(4-pyridylmethyl)indolin-3-olate Formula: C26H22N3O2- MolecularWeight: 408.47178

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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)(CC4=CC=NC=C4)[O-]

Isomeric SMILES

CC1=CC=NC=C1.C1=CC=C(C=C1)N2C3=CC=CC=C3C(C2=O)(CC4=CC=NC=C4)[O-]

InChI

InChI=1S/C20H15N2O2.C6H7N/c23-19-20(24,14-15-10-12-21-13-11-15)17-8-4-5-9-18(17)22(19)16-6-2-1-3-7-16;1-6-2-4-7-5-3-6/h1-13H,14H2;2-5H,1H3/q-1;