4-[4-(6-nitro-1,2,3,4-tetrahydroquinolin-4-yl)-3-oxidanylidene-butyl]benzenecarbonitrile

Systemtic Name: 4-[4-(6-nitro-1,2,3,4-tetrahydroquinolin-4-yl)-3-oxidanylidene-butyl]benzenecarbonitrile Openeye Name: 4-[4-(6-nitro-1,2,3,4-tetrahydroquinolin-4-yl)-3-oxo-butyl]benzonitrile CAS Name: 4-[4-(6-nitro-1,2,3,4-tetrahydroquinolin-4-yl)-3-oxobutyl]benzonitrile IUPAC Name: 4-[4-(6-nitro-1,2,3,4-tetrahydroquinolin-4-yl)-3-oxobutyl]benzonitrile Traditional Name: 4-[3-keto-4-(6-nitro-1,2,3,4-tetrahydroquinolin-4-yl)butyl]benzonitrile Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=C(C1CC(=O)CCC3=CC=C(C=C3)C#N)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CNC2=C(C1CC(=O)CCC3=CC=C(C=C3)C#N)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O3/c21-13-15-3-1-14(2-4-15)5-7-18(24)11-16-9-10-22-20-8-6-17(23(25)26)12-19(16)20/h1-4,6,8,12,16,22H,5,7,9-11H2