3-[[2-oxidanylidene-1-phenyl-3-(pyridin-4-ylmethyl)-3H-indol-4-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[2-oxidanylidene-1-phenyl-3-(pyridin-4-ylmethyl)-3H-indol-4-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[2-oxo-1-phenyl-3-(4-pyridylmethyl)indolin-4-yl]methyl]benzonitrile CAS Name: 3-[[2-oxo-1-phenyl-3-(pyridin-4-ylmethyl)-3H-indol-4-yl]methyl]benzonitrile IUPAC Name: 3-[[2-oxo-1-phenyl-3-(pyridin-4-ylmethyl)-3H-indol-4-yl]methyl]benzonitrile Traditional Name: 3-[[2-keto-1-phenyl-3-(4-pyridylmethyl)indolin-4-yl]methyl]benzonitrile Formula: C28H21N3O MolecularWeight: 415.48584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=CC=CC(=C3C(C2=O)CC4=CC=NC=C4)CC5=CC=CC(=C5)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C3=CC=CC(=C3C(C2=O)CC4=CC=NC=C4)CC5=CC=CC(=C5)C#N

InChI

InChI=1S/C28H21N3O/c29-19-22-7-4-6-21(16-22)17-23-8-5-11-26-27(23)25(18-20-12-14-30-15-13-20)28(32)31(26)24-9-2-1-3-10-24/h1-16,25H,17-18H2