3-[1-(5-bromanylpentyl)-2-oxidanylidene-quinolin-3-yl]benzenecarbonitrile

Systemtic Name: 3-[1-(5-bromanylpentyl)-2-oxidanylidene-quinolin-3-yl]benzenecarbonitrile Openeye Name: 3-[1-(5-bromopentyl)-2-oxo-3-quinolyl]benzonitrile CAS Name: 3-[1-(5-bromopentyl)-2-oxo-3-quinolinyl]benzonitrile IUPAC Name: 3-[1-(5-bromopentyl)-2-oxoquinolin-3-yl]benzonitrile Traditional Name: 3-[1-(5-bromopentyl)-2-keto-3-quinolyl]benzonitrile Formula: C21H19BrN2O MolecularWeight: 395.29236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)N2CCCCCBr)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)N2CCCCCBr)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H19BrN2O/c22-11-4-1-5-12-24-20-10-3-2-8-18(20)14-19(21(24)25)17-9-6-7-16(13-17)15-23/h2-3,6-10,13-14H,1,4-5,11-12H2